5,6-dichloropyridin-3-ol

C5H3Cl2NO — CID 14391672

IUPAC5,6-dichloropyridin-3-ol
SMILESOc1cnc(Cl)c(Cl)c1
InChIInChI=1S/C5H3Cl2NO/c6-4-1-3(9)2-8-5(4)7/h1-2,9H
InChIKeyGMHPKIGFTDRQBP-UHFFFAOYSA-N
MW163.99 g/mol
LogP2.09
Rot. Bonds

About 5,6-dichloropyridin-3-ol

5,6-dichloropyridin-3-ol (PubChem CID 14391672) has the molecular formula C5H3Cl2NO and a molecular weight of 163.99 g/mol. Its IUPAC name is 5,6-dichloropyridin-3-ol.

Molecular Properties

Compound Name5,6-dichloropyridin-3-ol
PubChem CID14391672
Molecular FormulaC5H3Cl2NO
Molecular Weight163.99 g/mol
Exact Mass162.96
IUPAC Name5,6-dichloropyridin-3-ol
SMILESOc1cnc(Cl)c(Cl)c1
InChIInChI=1S/C5H3Cl2NO/c6-4-1-3(9)2-8-5(4)7/h1-2,9H
InChIKeyGMHPKIGFTDRQBP-UHFFFAOYSA-N
XLogP2.09
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.99
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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 5,6-dichloropyridin-3-ol?
The IUPAC name of 5,6-dichloropyridin-3-ol (CID 14391672) is 5,6-dichloropyridin-3-ol.
What is the SMILES notation for 5,6-dichloropyridin-3-ol?
The canonical SMILES for 5,6-dichloropyridin-3-ol is Oc1cnc(Cl)c(Cl)c1.
What is the InChIKey of 5,6-dichloropyridin-3-ol?
The InChIKey is GMHPKIGFTDRQBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H3Cl2NO/c6-4-1-3(9)2-8-5(4)7/h1-2,9H.
What are the key properties of 5,6-dichloropyridin-3-ol?
5,6-dichloropyridin-3-ol has a molecular weight of 163.99 g/mol, XLogP of 2.09, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dichloropyridin-3-ol is sourced from PubChem (CID 14391672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).