C13H15N3O3 — CID 79204687
4-hydroxy-N-[4-(2-oxo-1H-imidazol-3-yl)phenyl]butanamide (PubChem CID 79204687) has the molecular formula C13H15N3O3 and a molecular weight of 261.28 g/mol. Its IUPAC name is 4-hydroxy-N-[4-(2-oxo-1H-imidazol-3-yl)phenyl]butanamide.
| Compound Name | 4-hydroxy-N-[4-(2-oxo-1H-imidazol-3-yl)phenyl]butanamide |
|---|---|
| PubChem CID | 79204687 |
| Molecular Formula | C13H15N3O3 |
| Molecular Weight | 261.28 g/mol |
| Exact Mass | 261.11 |
| IUPAC Name | 4-hydroxy-N-[4-(2-oxo-1H-imidazol-3-yl)phenyl]butanamide |
| SMILES | O=C(CCCO)Nc1ccc(-n2cc[nH]c2=O)cc1 |
| InChI | InChI=1S/C13H15N3O3/c17-9-1-2-12(18)15-10-3-5-11(6-4-10)16-8-7-14-13(16)19/h3-8,17H,1-2,9H2,(H,14,19)(H,15,18) |
| InChIKey | NHIONYCSCVPOMB-UHFFFAOYSA-N |
| XLogP | 0.88 |
| TPSA | 87.12 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 19 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 261.28 |
| LogP ≤ 5 | 0.88 |
| H-Bond Donors ≤ 5 | 3 |
| H-Bond Acceptors ≤ 10 | 4 |