About 6-chloro-5-(2,4-dichlorophenyl)pyridin-3-ol
6-chloro-5-(2,4-dichlorophenyl)pyridin-3-ol (PubChem CID 119005357) has the molecular formula C11H6Cl3NO
and a molecular weight of 274.53 g/mol. Its IUPAC name is 6-chloro-5-(2,4-dichlorophenyl)pyridin-3-ol.
Molecular Properties
| Compound Name | 6-chloro-5-(2,4-dichlorophenyl)pyridin-3-ol |
| PubChem CID | 119005357 |
| Molecular Formula | C11H6Cl3NO |
| Molecular Weight | 274.53 g/mol |
| Exact Mass | 272.95 |
| IUPAC Name | 6-chloro-5-(2,4-dichlorophenyl)pyridin-3-ol |
| SMILES | Oc1cnc(Cl)c(-c2ccc(Cl)cc2Cl)c1 |
| InChI | InChI=1S/C11H6Cl3NO/c12-6-1-2-8(10(13)3-6)9-4-7(16)5-15-11(9)14/h1-5,16H |
| InChIKey | LCDMIOMANNCRJD-UHFFFAOYSA-N |
| XLogP | 4.41 |
| TPSA | 33.12 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 274.53 |
| LogP ≤ 5 | 4.41 |
| H-Bond Donors ≤ 5 | 1 |
| 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 6-chloro-5-(2,4-dichlorophenyl)pyridin-3-ol?
The IUPAC name of 6-chloro-5-(2,4-dichlorophenyl)pyridin-3-ol (CID 119005357) is 6-chloro-5-(2,4-dichlorophenyl)pyridin-3-ol.
What is the SMILES notation for 6-chloro-5-(2,4-dichlorophenyl)pyridin-3-ol?
The canonical SMILES for 6-chloro-5-(2,4-dichlorophenyl)pyridin-3-ol is Oc1cnc(Cl)c(-c2ccc(Cl)cc2Cl)c1.
What is the InChIKey of 6-chloro-5-(2,4-dichlorophenyl)pyridin-3-ol?
The InChIKey is LCDMIOMANNCRJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H6Cl3NO/c12-6-1-2-8(10(13)3-6)9-4-7(16)5-15-11(9)14/h1-5,16H.
What are the key properties of 6-chloro-5-(2,4-dichlorophenyl)pyridin-3-ol?
6-chloro-5-(2,4-dichlorophenyl)pyridin-3-ol has a molecular weight of 274.53 g/mol, XLogP of 4.41, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-5-(2,4-dichlorophenyl)pyridin-3-ol is sourced from PubChem (CID 119005357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).