About 2,5-dichloro-3-pyridin-2-ylpyridine
2,5-dichloro-3-pyridin-2-ylpyridine (PubChem CID 150433968) has the molecular formula C10H6Cl2N2
and a molecular weight of 225.08 g/mol. Its IUPAC name is 2,5-dichloro-3-pyridin-2-ylpyridine.
Molecular Properties
| Compound Name | 2,5-dichloro-3-pyridin-2-ylpyridine |
| PubChem CID | 150433968 |
| Molecular Formula | C10H6Cl2N2 |
| Molecular Weight | 225.08 g/mol |
| Exact Mass | 223.99 |
| IUPAC Name | 2,5-dichloro-3-pyridin-2-ylpyridine |
| SMILES | Clc1cnc(Cl)c(-c2ccccn2)c1 |
| InChI | InChI=1S/C10H6Cl2N2/c11-7-5-8(10(12)14-6-7)9-3-1-2-4-13-9/h1-6H |
| InChIKey | HKJDXUFRUBEFPL-UHFFFAOYSA-N |
| XLogP | 3.45 |
| TPSA | 25.78 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 225.08 |
| LogP ≤ 5 | 3.45 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 2,5-dichloro-3-pyridin-2-ylpyridine?
The IUPAC name of 2,5-dichloro-3-pyridin-2-ylpyridine (CID 150433968) is 2,5-dichloro-3-pyridin-2-ylpyridine.
What is the SMILES notation for 2,5-dichloro-3-pyridin-2-ylpyridine?
The canonical SMILES for 2,5-dichloro-3-pyridin-2-ylpyridine is Clc1cnc(Cl)c(-c2ccccn2)c1.
What is the InChIKey of 2,5-dichloro-3-pyridin-2-ylpyridine?
The InChIKey is HKJDXUFRUBEFPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6Cl2N2/c11-7-5-8(10(12)14-6-7)9-3-1-2-4-13-9/h1-6H.
What are the key properties of 2,5-dichloro-3-pyridin-2-ylpyridine?
2,5-dichloro-3-pyridin-2-ylpyridine has a molecular weight of 225.08 g/mol, XLogP of 3.45, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dichloro-3-pyridin-2-ylpyridine is sourced from PubChem (CID 150433968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).