N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(pyridin-2-yl)pyrrolidin-3-yl]quinoline-2-carboxamide
Chemical Structure Depiction of
N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(pyridin-2-yl)pyrrolidin-3-yl]quinoline-2-carboxamide
N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(pyridin-2-yl)pyrrolidin-3-yl]quinoline-2-carboxamide
Compound characteristics
| Compound ID: | S639-1057 |
| Compound Name: | N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(pyridin-2-yl)pyrrolidin-3-yl]quinoline-2-carboxamide |
| Molecular Weight: | 375.47 |
| Molecular Formula: | C22 H25 N5 O |
| Smiles: | CN(C)C[C@@H]1CN(C[C@H]1NC(c1ccc2ccccc2n1)=O)c1ccccn1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.6622 |
| logD: | 0.5236 |
| logSw: | -2.926 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.99 |
| InChI Key: | YDQJCQMRMSNJEZ-PXNSSMCTSA-N |