Aralkylamines
Betahistine, TRC
CAS: 5638-76-6 Molecular Formula: C8H12N2 Molecular Weight (g/mol): 136.19 Synonym: N-Methyl-2-pyridineethanamine,2-(2-Methylaminoethyl)pyridine,2-(beta-Methylaminoethyl)pyridine,Methyl(2-pyridin-2-ylethyl)amine,N-Methyl-2-(2-pyridinyl)ethanamine,N-Methyl-2-(2-pyridyl)ethylamine,N-Methyl-2-pyridineethylamine,N-Methyl-N-[2-(2-pyridinyl)ethyl]amine,N-Methyl-N-[2-(pyridin-2-yl)ethyl]amine,N-Methyl[2-(pyridin-2-yl)ethyl]amine,N-[2-(2-Pyridyl)ethyl]-N-methylamine,NSC 42617,OBE 101,Y-G 14,[2-(2-Pyridyl)ethyl]methylamine,beta-Histine; IUPAC Name: N-methyl-2-pyridin-2-ylethanamine SMILES: CNCCc1ccccn1
Bromantane, TRC
CAS: 87913-26-6 Molecular Formula: C16 H20 Br N Molecular Weight (g/mol): 306.24 Synonym: Tricyclo[3.3.1.13,7]decan-2-amine, N-(4-bromophenyl)-,N-(4-Bromophenyl)tricyclo[3.3.1.13,7]decan-2-amine,Bromantan,Bromantane IUPAC Name: N-(4-bromophenyl)adamantan-2-amine SMILES: Brc1ccc(NC2[C@@H]3C[C@H]4C[C@H](C[C@@H]2C4)C3)cc1
Muscimol, TRC
CAS: 2763-96-4 Molecular Formula: C4 H6 N2 O2 Molecular Weight (g/mol): 114.1 IUPAC Name: 5-(aminomethyl)-1,2-oxazol-3-one SMILES: NCC1=CC(=O)NO1
(S)-(-)-Anatabine, TRC
CAS: 581-49-7 Molecular Formula: *C6C4H12N2 Molecular Weight (g/mol): 166.2 Synonym: 2,3'-Bipyridine, 1,2,3,6-tetrahydro-, (2S)- (9CI, ACI),(2S)-1,2,3,6-Tetrahydro-2,3'-bipyridine (ACI),2,3'-Bipyridine, 1,2,3,6-tetrahydro-, (S)- (ZCI),Anatabine (6CI, 7CI, 8CI),(-)-Anatabine,(S)-(-)-Anatabine,(S)-Anatabine,3-[(2S)-1,2,3,6-Tetrahydropyridin-2-yl]pyridine,Anatabine, (-)- IUPAC Name: 3-[(2S)-1,2,3,6-tetrahydropyridin-2-yl]pyridine SMILES: C1N[C@@H](CC=C1)c2cccnc2
Procyclidine Hydrochloride, TRC
CAS: 1508-76-5 Molecular Formula: C19 H29 N O . Cl H Molecular Weight (g/mol): 323.9 Synonym: 1-Pyrrolidinepropanol, α-cyclohexyl-α-phenyl-, hydrochloride (1:1),1-Pyrrolidinepropanol, α-cyclohexyl-α-phenyl-, hydrochloride (6CI,7CI,8CI,9CI),(±)-Procyclidine hydrochloride,1-Cyclohexyl-1-phenyl-3-pyrrolidino-1-propanol hydrochloride,Arpicolin,Kemadrin,Kemadrin hydrochloride,Osnervan,Procyclidine hydrochloride,Tricyclamol hydrochloride IUPAC Name: 1-cyclohexyl-1-phenyl-3-pyrrolidin-1-ylpropan-1-ol;hydrochloride SMILES: Cl.OC(CCN1CCCC1)(C2CCCCC2)c3ccccc3
N-Methylaniline, TRC
CAS: 100-61-8 Molecular Formula: C7 H9 N Molecular Weight (g/mol): 107.15 Synonym: Benzenamine, N-methyl- (9CI, ACI),Aniline, N-methyl- (8CI),N-Methylbenzenamine (ACI),(Methylamino)benzene,Anilinomethane,Methyl(phenyl)amine,Methylaniline,N-Methyl-N-phenylamine,N-Methylaniline,N-Methylphenylamine,N-Monomethylaniline,N-Phenyl-N-methylamine,N-Phenylmethylamine,NSC 3502 IUPAC Name: N-methylaniline SMILES: CNc1ccccc1
Betahistine Dihydrochloride, TRC
CAS: 5579-84-0 Molecular Formula: C8 H12 N2 . 2 Cl H Molecular Weight (g/mol): 209.12 Synonym: Betahistine Dihydrochloride,N-Methyl-2-pyridineethanamine hydrochloride (1:2),N-Methyl-2-pyridineethanamine dihydrochloride,2-[2-(Methylamino)ethyl]pyridine dihydrochloride,Betahistine dihydrochloride,Betahistine hydrochloride,Betaserc,PT 9,Serc,Sinmenier,Vasomotal IUPAC Name: N-methyl-2-pyridin-2-ylethanamine;dihydrochloride SMILES: Cl.Cl.CNCCc1ccccn1
(±)-Pramipexole, TRC
CAS: 104617-86-9 Molecular Formula: C10H17N3S Molecular Weight (g/mol): 211.33 Synonym: 2-Amino-6-propylamino-4,5,6,7-tetrahydrobenzothiazole,4,5,6,7-Tetrahydro-N6-propyl-2,6-Benzothiazolediamine; IUPAC Name: 6-N-propyl-4,5,6,7-tetrahydro-1,3-benzothiazole-2,6-diamine SMILES: NC(S1)=NC2=C1C[C@H](NCCC)CC2
Tranylcypromine Hydrochloride, TRC
CAS: 4548-34-9 Molecular Formula: C9 H12 Cl N Molecular Weight (g/mol): 169.65 Synonym: Cyclopropanamine, 2-phenyl-, hydrochloride (1:1), (1S,2R)- (ACI),Cyclopropanamine, 2-phenyl-, hydrochloride, (1S,2R)- (9CI),Cyclopropanamine, 2-phenyl-, hydrochloride, (1S-trans)- (ZCI),Cyclopropylamine, 2-phenyl-, hydrochloride, trans-(+)- (8CI),(1S,2R)-2-Phenylcyclopropanamine hydrochloride,1-(S)-Amino-2-(R)-phenylcyclopropane hydrochloride,d-Tranylcypromine hydrochloride,Tranylcypromine hydrochloride,(+)-Tranylcypromine hydrochloride,(1S,2R)-Tranylcypromine hydrochloride IUPAC Name: (1S,2R)-2-phenylcyclopropan-1-amine;hydrochloride SMILES: Cl.N[C@H]1C[C@@H]1c2ccccc2
Nefopam Hydrochloride, TRC
CAS: 23327-57-3 Molecular Formula: C17 H19 N O . Cl H Molecular Weight (g/mol): 289.8 Synonym: 1H-2,5-Benzoxazocine, 3,4,5,6-tetrahydro-5-methyl-1-phenyl-, hydrochloride (1:1),1H-2,5-Benzoxazocine, 3,4,5,6-tetrahydro-5-methyl-1-phenyl-, hydrochloride (8CI,9CI),(±)-Nefopam hydrochloride,Acupan,Ajan,Fenazoxine,Fenazoxine hydrochloride,Nefopam hydrochloride,R 738 IUPAC Name: 5-methyl-1-phenyl-1,3,4,6-tetrahydro-2,5-benzoxazocine;hydrochloride SMILES: Cl.CN1CCOC(c2ccccc2)c3ccccc3C1
PNU 142300, TRC
CAS: 368891-69-4 Molecular Formula: C16H20FN3O6 Molecular Weight (g/mol): 369.34 Synonym: N-[4-[(5S)-5-[(Acetylamino)methyl]-2-oxo-3-oxazolidinyl]-2-fluorophenyl]-N-(2-hydroxyethyl)glycine; SMILES: CC(=O)NC[C@H]1CN(C(=O)O1)C2=CC(=C(C=C2)NCCOCC(=O)O)F
Muscimol Hydrobromide, TRC
CAS: 18174-72-6 Molecular Formula: C4 H6 N2 O2 . Br H Molecular Weight (g/mol): 195.01 Synonym: Muscimol HBr IUPAC Name: 5-(aminomethyl)-1,2-oxazol-3-ol;hydrobromide SMILES: Br.NCc1onc(O)c1
(R,S)-Anatabine, TRC
CAS: 2743-90-0 Molecular Formula: C10 H12 N2 Molecular Weight (g/mol): 160.22 Synonym: 2,3'-Bipyridine, 1,2,3,6-tetrahydro- (9CI, ACI),1,2,3,6-Tetrahydro-2,3'-bipyridine (ACI),2,3'-Bipyridine, 1,2,3,6-tetrahydro-, (±)- (ZCI),(RS)-Anatabine,(±)-1,2,3,6-Tetrahydro-2,3'-bipyridine,(±)-Anatabine,1,2,3,6-Tetrahydro-2,3'-dipyridine,3-(1,2,3,6-Tetrahydropyridin-2-yl)pyridine IUPAC Name: 3-(1,2,3,6-tetrahydropyridin-2-yl)pyridine SMILES: C1NC(CC=C1)c2cccnc2
DL-alpha-Methylbenzylamine, TRC
CAS: 618-36-0 Molecular Formula: C8 H11 N Molecular Weight (g/mol): 121.18 Synonym: Benzenemethanamine, α-methyl-,1-Phenylethanamine,α-Phenylethylamine IUPAC Name: 1-phenylethanamine SMILES: CC(N)c1ccccc1