N-[3-(dimethylamino)propyl]-3-methyl-4-nitrobenzamide
Chemical Structure Depiction of
N-[3-(dimethylamino)propyl]-3-methyl-4-nitrobenzamide
N-[3-(dimethylamino)propyl]-3-methyl-4-nitrobenzamide
Compound characteristics
| Compound ID: | Y031-9813 |
| Compound Name: | N-[3-(dimethylamino)propyl]-3-methyl-4-nitrobenzamide |
| Molecular Weight: | 265.31 |
| Molecular Formula: | C13 H19 N3 O3 |
| Smiles: | Cc1cc(ccc1[N+]([O-])=O)C(NCCCN(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4472 |
| logD: | -0.967 |
| logSw: | -2.3097 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.711 |
| InChI Key: | XRRRVNQSXOXWLK-UHFFFAOYSA-N |