C14H11ClN2O4 — CID 125473172
2-[[6-(4-chlorophenyl)-2-oxo-1H-pyridine-3-carbonyl]amino]acetic acid (PubChem CID 125473172) has the molecular formula C14H11ClN2O4 and a molecular weight of 306.71 g/mol. Its IUPAC name is 2-[[6-(4-chlorophenyl)-2-oxo-1H-pyridine-3-carbonyl]amino]acetic acid.
| Compound Name | 2-[[6-(4-chlorophenyl)-2-oxo-1H-pyridine-3-carbonyl]amino]acetic acid |
|---|---|
| PubChem CID | 125473172 |
| Molecular Formula | C14H11ClN2O4 |
| Molecular Weight | 306.71 g/mol |
| Exact Mass | 306.04 |
| IUPAC Name | 2-[[6-(4-chlorophenyl)-2-oxo-1H-pyridine-3-carbonyl]amino]acetic acid |
| SMILES | O=C(O)CNC(=O)c1ccc(-c2ccc(Cl)cc2)[nH]c1=O |
| InChI | InChI=1S/C14H11ClN2O4/c15-9-3-1-8(2-4-9)11-6-5-10(14(21)17-11)13(20)16-7-12(18)19/h1-6H,7H2,(H,16,20)(H,17,21)(H,18,19) |
| InChIKey | GKHJUZJNSABYLC-UHFFFAOYSA-N |
| XLogP | 1.51 |
| TPSA | 99.26 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 21 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 306.71 |
| LogP ≤ 5 | 1.51 |
| H-Bond Donors ≤ 5 | 3 |
| H-Bond Acceptors ≤ 10 | 3 |