N-{rel-(3R,4S)-1-benzyl-4-[(dimethylamino)methyl]pyrrolidin-3-yl}cyclohexanecarboxamide
Chemical Structure Depiction of
N-{rel-(3R,4S)-1-benzyl-4-[(dimethylamino)methyl]pyrrolidin-3-yl}cyclohexanecarboxamide
N-{rel-(3R,4S)-1-benzyl-4-[(dimethylamino)methyl]pyrrolidin-3-yl}cyclohexanecarboxamide
Compound characteristics
Compound ID: | S639-9217 |
Compound Name: | N-{rel-(3R,4S)-1-benzyl-4-[(dimethylamino)methyl]pyrrolidin-3-yl}cyclohexanecarboxamide |
Molecular Weight: | 343.51 |
Molecular Formula: | C21 H33 N3 O |
Smiles: | CN(C)C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(C1CCCCC1)=O |
Stereo: | RACEMIC MIXTURE (RELATIVE) |
logP: | 2.494 |
logD: | 0.3697 |
logSw: | -2.5496 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 32.62 |
InChI Key: | KJMVMUSLOARZRN-PMACEKPBSA-N |