4-carbamoyl-1-[2-(dimethylamino)-2-oxoethyl]pyridin-1-ium
Chemical Structure Depiction of
4-carbamoyl-1-[2-(dimethylamino)-2-oxoethyl]pyridin-1-ium
4-carbamoyl-1-[2-(dimethylamino)-2-oxoethyl]pyridin-1-ium
Compound characteristics
| Compound ID: | 0173-0008 |
| Compound Name: | 4-carbamoyl-1-[2-(dimethylamino)-2-oxoethyl]pyridin-1-ium |
| Molecular Weight: | 243.69 |
| Molecular Formula: | C10 H14 N3 O2 |
| Salt: | Cl- |
| Smiles: | CN(C)C(C[n+]1ccc(cc1)C(N)=O)=O |
| Stereo: | ACHIRAL |
| logP: | -1.1855 |
| logD: | -1.1855 |
| logSw: | -1.0343 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.835 |
| InChI Key: | KXQYNJYDXNBEBP-UHFFFAOYSA-O |