C17H12N4O — CID 117164759
4-(2-pyridin-3-ylimidazo[4,5-b]pyridin-3-yl)phenol (PubChem CID 117164759) has the molecular formula C17H12N4O and a molecular weight of 288.31 g/mol. Its IUPAC name is 4-(2-pyridin-3-ylimidazo[4,5-b]pyridin-3-yl)phenol.
| Compound Name | 4-(2-pyridin-3-ylimidazo[4,5-b]pyridin-3-yl)phenol |
|---|---|
| PubChem CID | 117164759 |
| Molecular Formula | C17H12N4O |
| Molecular Weight | 288.31 g/mol |
| Exact Mass | 288.10 |
| IUPAC Name | 4-(2-pyridin-3-ylimidazo[4,5-b]pyridin-3-yl)phenol |
| SMILES | Oc1ccc(-n2c(-c3cccnc3)nc3cccnc32)cc1 |
| InChI | InChI=1S/C17H12N4O/c22-14-7-5-13(6-8-14)21-16(12-3-1-9-18-11-12)20-15-4-2-10-19-17(15)21/h1-11,22H |
| InChIKey | NTHUYFVWIXPCLJ-UHFFFAOYSA-N |
| XLogP | 3.19 |
| TPSA | 63.83 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 22 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 288.31 |
| LogP ≤ 5 | 3.19 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 5 |