About 3-methoxy-2-(4-methylimidazol-1-yl)pyridine
3-methoxy-2-(4-methylimidazol-1-yl)pyridine (PubChem CID 141128975) has the molecular formula C10H11N3O
and a molecular weight of 189.22 g/mol. Its IUPAC name is 3-methoxy-2-(4-methylimidazol-1-yl)pyridine.
Molecular Properties
| Compound Name | 3-methoxy-2-(4-methylimidazol-1-yl)pyridine |
| PubChem CID | 141128975 |
| Molecular Formula | C10H11N3O |
| Molecular Weight | 189.22 g/mol |
| Exact Mass | 189.09 |
| IUPAC Name | 3-methoxy-2-(4-methylimidazol-1-yl)pyridine |
| SMILES | COc1cccnc1-n1cnc(C)c1 |
| InChI | InChI=1S/C10H11N3O/c1-8-6-13(7-12-8)10-9(14-2)4-3-5-11-10/h3-7H,1-2H3 |
| InChIKey | NYMJOTNIULJXKS-UHFFFAOYSA-N |
| XLogP | 1.58 |
| TPSA | 39.94 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 189.22 |
| LogP ≤ 5 | 1.58 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of 3-methoxy-2-(4-methylimidazol-1-yl)pyridine?
The IUPAC name of 3-methoxy-2-(4-methylimidazol-1-yl)pyridine (CID 141128975) is 3-methoxy-2-(4-methylimidazol-1-yl)pyridine.
What is the SMILES notation for 3-methoxy-2-(4-methylimidazol-1-yl)pyridine?
The canonical SMILES for 3-methoxy-2-(4-methylimidazol-1-yl)pyridine is COc1cccnc1-n1cnc(C)c1.
What is the InChIKey of 3-methoxy-2-(4-methylimidazol-1-yl)pyridine?
The InChIKey is NYMJOTNIULJXKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O/c1-8-6-13(7-12-8)10-9(14-2)4-3-5-11-10/h3-7H,1-2H3.
What are the key properties of 3-methoxy-2-(4-methylimidazol-1-yl)pyridine?
3-methoxy-2-(4-methylimidazol-1-yl)pyridine has a molecular weight of 189.22 g/mol, XLogP of 1.58, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-2-(4-methylimidazol-1-yl)pyridine is sourced from PubChem (CID 141128975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).