AC1Q5RKT

3-[(4aR,7aS)-2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl]-N-(2,5-dimethylphenyl)propanamide;oxalic acid

Also Known As: trans-N-(2,5-Dimethylphenyl)octahydro-1H-pyrindine-1-propanamide oxalate|1H-Pyrindine-1-propanamide, N-(2,5-dimethylphenyl)octahydro-, trans-, ethanedioate|n-(2,5-dimethylphenyl)-3-[(4ar,7as)-octahydro-1h-cyclopenta[b]pyridin-1-yl]propanamide ethanedioate(1:1)|3-[(4aR,7aS)-2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl]-N-(2,5-dimethylphenyl)propanamide; oxalic acid|Oxalic acid--N-(2,5-dimethylphenyl)-3-(octahydro-1H-cyclopenta[b]pyridin-1-yl)propanimidic acid (1/1)|Oxalic acid--N-(2,5-dimethylphenyl)-3-[(4aR,7aS)-octahydro-1H-cyclopenta[b]pyridin-1-yl]propanimidic acid (1/1)

Molecular Formula	C21H30N2O5
Molecular Weight	390.21548 g/mol
LogP	3.05214
Topological Polar Surface Area	107.0 Ų
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	6
Rotatable Bonds	5
Exact Mass	390.21548
Monoisotopic Mass	390.21548
Heavy Atoms	28
Complexity	455.0

Chemical Identifiers

CAS Number	51682-76-9
SMILES	CC1=CC(=C(C=C1)C)NC(=O)CCN2CCC[C@@H]3[C@@H]2CCC3.C(=O)(C(=O)O)O
InChIKey	HAZJJZZQPCALED-CLRXKPRGSA-N