About 3-(5-ethyl-1H-imidazol-4-yl)pyridine
3-(5-ethyl-1H-imidazol-4-yl)pyridine (PubChem CID 45120975) has the molecular formula C10H11N3
and a molecular weight of 173.22 g/mol. Its IUPAC name is 3-(5-ethyl-1H-imidazol-4-yl)pyridine.
Molecular Properties
| Compound Name | 3-(5-ethyl-1H-imidazol-4-yl)pyridine |
| PubChem CID | 45120975 |
| Molecular Formula | C10H11N3 |
| Molecular Weight | 173.22 g/mol |
| Exact Mass | 173.10 |
| IUPAC Name | 3-(5-ethyl-1H-imidazol-4-yl)pyridine |
| SMILES | CCc1[nH]cnc1-c1cccnc1 |
| InChI | InChI=1S/C10H11N3/c1-2-9-10(13-7-12-9)8-4-3-5-11-6-8/h3-7H,2H2,1H3,(H,12,13) |
| InChIKey | CHSUJCFGCWEMFX-UHFFFAOYSA-N |
| XLogP | 2.03 |
| TPSA | 41.57 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 173.22 |
| LogP ≤ 5 | 2.03 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 3-(5-ethyl-1H-imidazol-4-yl)pyridine?
The IUPAC name of 3-(5-ethyl-1H-imidazol-4-yl)pyridine (CID 45120975) is 3-(5-ethyl-1H-imidazol-4-yl)pyridine.
What is the SMILES notation for 3-(5-ethyl-1H-imidazol-4-yl)pyridine?
The canonical SMILES for 3-(5-ethyl-1H-imidazol-4-yl)pyridine is CCc1[nH]cnc1-c1cccnc1.
What is the InChIKey of 3-(5-ethyl-1H-imidazol-4-yl)pyridine?
The InChIKey is CHSUJCFGCWEMFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3/c1-2-9-10(13-7-12-9)8-4-3-5-11-6-8/h3-7H,2H2,1H3,(H,12,13).
What are the key properties of 3-(5-ethyl-1H-imidazol-4-yl)pyridine?
3-(5-ethyl-1H-imidazol-4-yl)pyridine has a molecular weight of 173.22 g/mol, XLogP of 2.03, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-ethyl-1H-imidazol-4-yl)pyridine is sourced from PubChem (CID 45120975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).