About 3,5-dichloro-2-(2-methylimidazol-1-yl)pyridine
3,5-dichloro-2-(2-methylimidazol-1-yl)pyridine (PubChem CID 63811503) has the molecular formula C9H7Cl2N3
and a molecular weight of 228.08 g/mol. Its IUPAC name is 3,5-dichloro-2-(2-methylimidazol-1-yl)pyridine.
Molecular Properties
| Compound Name | 3,5-dichloro-2-(2-methylimidazol-1-yl)pyridine |
| PubChem CID | 63811503 |
| Molecular Formula | C9H7Cl2N3 |
| Molecular Weight | 228.08 g/mol |
| Exact Mass | 227.00 |
| IUPAC Name | 3,5-dichloro-2-(2-methylimidazol-1-yl)pyridine |
| SMILES | Cc1nccn1-c1ncc(Cl)cc1Cl |
| InChI | InChI=1S/C9H7Cl2N3/c1-6-12-2-3-14(6)9-8(11)4-7(10)5-13-9/h2-5H,1H3 |
| InChIKey | FUCTUXYSFATRRR-UHFFFAOYSA-N |
| XLogP | 2.88 |
| TPSA | 30.71 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 228.08 |
| LogP ≤ 5 | 2.88 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 3,5-dichloro-2-(2-methylimidazol-1-yl)pyridine?
The IUPAC name of 3,5-dichloro-2-(2-methylimidazol-1-yl)pyridine (CID 63811503) is 3,5-dichloro-2-(2-methylimidazol-1-yl)pyridine.
What is the SMILES notation for 3,5-dichloro-2-(2-methylimidazol-1-yl)pyridine?
The canonical SMILES for 3,5-dichloro-2-(2-methylimidazol-1-yl)pyridine is Cc1nccn1-c1ncc(Cl)cc1Cl.
What is the InChIKey of 3,5-dichloro-2-(2-methylimidazol-1-yl)pyridine?
The InChIKey is FUCTUXYSFATRRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7Cl2N3/c1-6-12-2-3-14(6)9-8(11)4-7(10)5-13-9/h2-5H,1H3.
What are the key properties of 3,5-dichloro-2-(2-methylimidazol-1-yl)pyridine?
3,5-dichloro-2-(2-methylimidazol-1-yl)pyridine has a molecular weight of 228.08 g/mol, XLogP of 2.88, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-2-(2-methylimidazol-1-yl)pyridine is sourced from PubChem (CID 63811503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).