4-carbamoyl-1-[2-(diethylamino)-2-oxoethyl]pyridin-1-ium--chloride (1/1)
Chemical Structure Depiction of
4-carbamoyl-1-[2-(diethylamino)-2-oxoethyl]pyridin-1-ium--chloride (1/1)
4-carbamoyl-1-[2-(diethylamino)-2-oxoethyl]pyridin-1-ium--chloride (1/1)
Compound characteristics
| Compound ID: | 0173-0009 |
| Compound Name: | 4-carbamoyl-1-[2-(diethylamino)-2-oxoethyl]pyridin-1-ium--chloride (1/1) |
| Molecular Weight: | 271.74 |
| Molecular Formula: | C12 H18 N3 O2 |
| Salt: | Cl- |
| Smiles: | CCN(CC)C(C[n+]1ccc(cc1)C(N)=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.1524 |
| logD: | -0.1524 |
| logSw: | -1.0933 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.766 |
| InChI Key: | XXHIEXKLJCMPSR-UHFFFAOYSA-O |