C12H14N2O3 — CID 154667095
2,6-dimethoxy-4-(5-methyl-1H-imidazol-2-yl)phenol (PubChem CID 154667095) has the molecular formula C12H14N2O3 and a molecular weight of 234.25 g/mol. Its IUPAC name is 2,6-dimethoxy-4-(5-methyl-1H-imidazol-2-yl)phenol.
| Compound Name | 2,6-dimethoxy-4-(5-methyl-1H-imidazol-2-yl)phenol |
|---|---|
| PubChem CID | 154667095 |
| Molecular Formula | C12H14N2O3 |
| Molecular Weight | 234.25 g/mol |
| Exact Mass | 234.10 |
| IUPAC Name | 2,6-dimethoxy-4-(5-methyl-1H-imidazol-2-yl)phenol |
| SMILES | COc1cc(-c2ncc(C)[nH]2)cc(OC)c1O |
| InChI | InChI=1S/C12H14N2O3/c1-7-6-13-12(14-7)8-4-9(16-2)11(15)10(5-8)17-3/h4-6,15H,1-3H3,(H,13,14) |
| InChIKey | HQPQNQPNXAPQMU-UHFFFAOYSA-N |
| XLogP | 2.11 |
| TPSA | 67.37 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 17 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 234.25 |
| LogP ≤ 5 | 2.11 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 4 |