C15H13N3O — CID 135470346
4-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]phenol (PubChem CID 135470346) has the molecular formula C15H13N3O and a molecular weight of 251.29 g/mol. Its IUPAC name is 4-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]phenol.
| Compound Name | 4-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]phenol |
|---|---|
| PubChem CID | 135470346 |
| Molecular Formula | C15H13N3O |
| Molecular Weight | 251.29 g/mol |
| Exact Mass | 251.11 |
| IUPAC Name | 4-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]phenol |
| SMILES | Cc1cccc(-c2[nH]ncc2-c2ccc(O)cc2)n1 |
| InChI | InChI=1S/C15H13N3O/c1-10-3-2-4-14(17-10)15-13(9-16-18-15)11-5-7-12(19)8-6-11/h2-9,19H,1H3,(H,16,18) |
| InChIKey | YOLJORSLLBNCFO-UHFFFAOYSA-N |
| XLogP | 3.15 |
| TPSA | 61.80 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 19 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 251.29 |
| LogP ≤ 5 | 3.15 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |