C13H9BrN2O — CID 137006642
2-(8-bromoimidazo[1,5-a]pyridin-3-yl)phenol (PubChem CID 137006642) has the molecular formula C13H9BrN2O and a molecular weight of 289.13 g/mol. Its IUPAC name is 2-(8-bromoimidazo[1,5-a]pyridin-3-yl)phenol.
| Compound Name | 2-(8-bromoimidazo[1,5-a]pyridin-3-yl)phenol |
|---|---|
| PubChem CID | 137006642 |
| Molecular Formula | C13H9BrN2O |
| Molecular Weight | 289.13 g/mol |
| Exact Mass | 287.99 |
| IUPAC Name | 2-(8-bromoimidazo[1,5-a]pyridin-3-yl)phenol |
| SMILES | Oc1ccccc1-c1ncc2c(Br)cccn12 |
| InChI | InChI=1S/C13H9BrN2O/c14-10-5-3-7-16-11(10)8-15-13(16)9-4-1-2-6-12(9)17/h1-8,17H |
| InChIKey | FGFJKPQPMXNOSV-UHFFFAOYSA-N |
| XLogP | 3.47 |
| TPSA | 37.53 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 17 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 289.13 |
| LogP ≤ 5 | 3.47 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |