C12H8ClN3 — CID 86715478
6-(2-chloro-3-pyridinyl)imidazo[1,2-a]pyridine (PubChem CID 86715478) has the molecular formula C12H8ClN3 and a molecular weight of 229.67 g/mol. Its IUPAC name is 6-(2-chloro-3-pyridinyl)imidazo[1,2-a]pyridine.
| Compound Name | 6-(2-chloro-3-pyridinyl)imidazo[1,2-a]pyridine |
|---|---|
| PubChem CID | 86715478 |
| Molecular Formula | C12H8ClN3 |
| Molecular Weight | 229.67 g/mol |
| Exact Mass | 229.04 |
| IUPAC Name | 6-(2-chloro-3-pyridinyl)imidazo[1,2-a]pyridine |
| SMILES | Clc1ncccc1-c1ccc2nccn2c1 |
| InChI | InChI=1S/C12H8ClN3/c13-12-10(2-1-5-15-12)9-3-4-11-14-6-7-16(11)8-9/h1-8H |
| InChIKey | SUEOFXZHGLPDPU-UHFFFAOYSA-N |
| XLogP | 3.05 |
| TPSA | 30.19 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 16 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 229.67 |
| LogP ≤ 5 | 3.05 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
| Structural Alerts | {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'} |
|---|