About 2-chloro-5-(3-fluoro-2-pyridinyl)pyridine
2-chloro-5-(3-fluoro-2-pyridinyl)pyridine (PubChem CID 141353817) has the molecular formula C10H6ClFN2
and a molecular weight of 208.62 g/mol. Its IUPAC name is 2-chloro-5-(3-fluoro-2-pyridinyl)pyridine.
Molecular Properties
| Compound Name | 2-chloro-5-(3-fluoro-2-pyridinyl)pyridine |
| PubChem CID | 141353817 |
| Molecular Formula | C10H6ClFN2 |
| Molecular Weight | 208.62 g/mol |
| Exact Mass | 208.02 |
| IUPAC Name | 2-chloro-5-(3-fluoro-2-pyridinyl)pyridine |
| SMILES | Fc1cccnc1-c1ccc(Cl)nc1 |
| InChI | InChI=1S/C10H6ClFN2/c11-9-4-3-7(6-14-9)10-8(12)2-1-5-13-10/h1-6H |
| InChIKey | DOKCHFJOYKGZMR-UHFFFAOYSA-N |
| XLogP | 2.94 |
| 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 | 208.62 |
| LogP ≤ 5 | 2.94 |
| 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-chloro-5-(3-fluoro-2-pyridinyl)pyridine?
The IUPAC name of 2-chloro-5-(3-fluoro-2-pyridinyl)pyridine (CID 141353817) is 2-chloro-5-(3-fluoro-2-pyridinyl)pyridine.
What is the SMILES notation for 2-chloro-5-(3-fluoro-2-pyridinyl)pyridine?
The canonical SMILES for 2-chloro-5-(3-fluoro-2-pyridinyl)pyridine is Fc1cccnc1-c1ccc(Cl)nc1.
What is the InChIKey of 2-chloro-5-(3-fluoro-2-pyridinyl)pyridine?
The InChIKey is DOKCHFJOYKGZMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6ClFN2/c11-9-4-3-7(6-14-9)10-8(12)2-1-5-13-10/h1-6H.
What are the key properties of 2-chloro-5-(3-fluoro-2-pyridinyl)pyridine?
2-chloro-5-(3-fluoro-2-pyridinyl)pyridine has a molecular weight of 208.62 g/mol, XLogP of 2.94, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-(3-fluoro-2-pyridinyl)pyridine is sourced from PubChem (CID 141353817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).