3-[2-nitro-5-(pyrrolidin-1-yl)anilino]propan-1-ol
Chemical Structure Depiction of
3-[2-nitro-5-(pyrrolidin-1-yl)anilino]propan-1-ol
3-[2-nitro-5-(pyrrolidin-1-yl)anilino]propan-1-ol
Compound characteristics
| Compound ID: | 2023-0267 |
| Compound Name: | 3-[2-nitro-5-(pyrrolidin-1-yl)anilino]propan-1-ol |
| Molecular Weight: | 265.31 |
| Molecular Formula: | C13 H19 N3 O3 |
| Smiles: | C1CCN(C1)c1ccc(c(c1)NCCCO)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.0257 |
| logD: | 2.0257 |
| logSw: | -2.5352 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.443 |
| InChI Key: | BCTKQCQGINTGIP-UHFFFAOYSA-N |