About 2-(5-methylfuran-2-yl)-1H-imidazo[4,5-b]pyridine
2-(5-methylfuran-2-yl)-1H-imidazo[4,5-b]pyridine (PubChem CID 14369059) has the molecular formula C11H9N3O
and a molecular weight of 199.21 g/mol. Its IUPAC name is 2-(5-methylfuran-2-yl)-1H-imidazo[4,5-b]pyridine.
Molecular Properties
| Compound Name | 2-(5-methylfuran-2-yl)-1H-imidazo[4,5-b]pyridine |
| PubChem CID | 14369059 |
| Molecular Formula | C11H9N3O |
| Molecular Weight | 199.21 g/mol |
| Exact Mass | 199.07 |
| IUPAC Name | 2-(5-methylfuran-2-yl)-1H-imidazo[4,5-b]pyridine |
| SMILES | Cc1ccc(-c2nc3ncccc3[nH]2)o1 |
| InChI | InChI=1S/C11H9N3O/c1-7-4-5-9(15-7)11-13-8-3-2-6-12-10(8)14-11/h2-6H,1H3,(H,12,13,14) |
| InChIKey | MCXLGZZGLGNRIQ-UHFFFAOYSA-N |
| XLogP | 2.53 |
| TPSA | 54.71 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 199.21 |
| LogP ≤ 5 | 2.53 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 2-(5-methylfuran-2-yl)-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 2-(5-methylfuran-2-yl)-1H-imidazo[4,5-b]pyridine (CID 14369059) is 2-(5-methylfuran-2-yl)-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 2-(5-methylfuran-2-yl)-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 2-(5-methylfuran-2-yl)-1H-imidazo[4,5-b]pyridine is Cc1ccc(-c2nc3ncccc3[nH]2)o1.
What is the InChIKey of 2-(5-methylfuran-2-yl)-1H-imidazo[4,5-b]pyridine?
The InChIKey is MCXLGZZGLGNRIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9N3O/c1-7-4-5-9(15-7)11-13-8-3-2-6-12-10(8)14-11/h2-6H,1H3,(H,12,13,14).
What are the key properties of 2-(5-methylfuran-2-yl)-1H-imidazo[4,5-b]pyridine?
2-(5-methylfuran-2-yl)-1H-imidazo[4,5-b]pyridine has a molecular weight of 199.21 g/mol, XLogP of 2.53, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methylfuran-2-yl)-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 14369059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).