N-{rel-(3R,4S)-1-benzyl-4-[(dimethylamino)methyl]pyrrolidin-3-yl}propanamide
Chemical Structure Depiction of
N-{rel-(3R,4S)-1-benzyl-4-[(dimethylamino)methyl]pyrrolidin-3-yl}propanamide
N-{rel-(3R,4S)-1-benzyl-4-[(dimethylamino)methyl]pyrrolidin-3-yl}propanamide
Compound characteristics
| Compound ID: | S639-0433 |
| Compound Name: | N-{rel-(3R,4S)-1-benzyl-4-[(dimethylamino)methyl]pyrrolidin-3-yl}propanamide |
| Molecular Weight: | 289.42 |
| Molecular Formula: | C17 H27 N3 O |
| Smiles: | CCC(N[C@@H]1CN(Cc2ccccc2)C[C@H]1CN(C)C)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.3254 |
| logD: | -0.7988 |
| logSw: | -1.9487 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 32.486 |
| InChI Key: | AGPDKIBXBMCYBT-HOTGVXAUSA-N |