6-chloro-N-(3-fluoro-4-hydroxyphenyl)pyridine-3-carboxamide

C12H8ClFN2O2 — CID 64782062

IUPAC6-chloro-N-(3-fluoro-4-hydroxyphenyl)pyridine-3-carboxamide
SMILESO=C(Nc1ccc(O)c(F)c1)c1ccc(Cl)nc1
InChIInChI=1S/C12H8ClFN2O2/c13-11-4-1-7(6-15-11)12(18)16-8-2-3-10(17)9(14)5-8/h1-6,17H,(H,16,18)
InChIKeyVQXJXNIIAYBWPF-UHFFFAOYSA-N
MW266.66 g/mol
LogP2.83
Rot. Bonds2

About 6-chloro-N-(3-fluoro-4-hydroxyphenyl)pyridine-3-carboxamide

6-chloro-N-(3-fluoro-4-hydroxyphenyl)pyridine-3-carboxamide (PubChem CID 64782062) has the molecular formula C12H8ClFN2O2 and a molecular weight of 266.66 g/mol. Its IUPAC name is 6-chloro-N-(3-fluoro-4-hydroxyphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-chloro-N-(3-fluoro-4-hydroxyphenyl)pyridine-3-carboxamide
PubChem CID64782062
Molecular FormulaC12H8ClFN2O2
Molecular Weight266.66 g/mol
Exact Mass266.03
IUPAC Name6-chloro-N-(3-fluoro-4-hydroxyphenyl)pyridine-3-carboxamide
SMILESO=C(Nc1ccc(O)c(F)c1)c1ccc(Cl)nc1
InChIInChI=1S/C12H8ClFN2O2/c13-11-4-1-7(6-15-11)12(18)16-8-2-3-10(17)9(14)5-8/h1-6,17H,(H,16,18)
InChIKeyVQXJXNIIAYBWPF-UHFFFAOYSA-N
XLogP2.83
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.66
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'hydroquinone', 'substructure': 'N/A'}

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Related Compounds

6-chloro-N-(3-chloro-4-hydroxyphenyl)pyridine-3-carboxamide
CID 113226989
N-(4-bromo-3-fluorophenyl)-6-chloropyridine-3-carboxamide
CID 65435923
N-(3-acetamido-4-fluorophenyl)-6-chloropyridine-3-carboxamide
CID 60723641
N-[4-(azetidin-3-ylidenemethyl)-3-fluorophenyl]-6-chloropyridine-3-carboxamide
CID 118903444
N-(3-fluoro-4-hydroxyphenyl)pyrimidine-5-carboxamide
CID 102922040
N-(3-fluoro-4-hydroxyphenyl)pyridine-4-carboxamide
CID 64780099
6-chloro-N-(4-chloro-3-methylphenyl)pyridine-3-carboxamide
CID 91312921
N-(4-bromo-3-chlorophenyl)-6-chloropyridine-3-carboxamide
CID 113278384
6-chloro-N-(5-chloro-2-fluorophenyl)pyridine-3-carboxamide
CID 43384926
4-bromo-3-chloro-N-(3-fluoro-4-hydroxyphenyl)benzamide
CID 81295822
6-chloro-N-(2-chloropyrimidin-5-yl)pyridine-3-carboxamide
CID 10125350
3,4,5-trifluoro-N-(3-fluoro-4-hydroxyphenyl)benzamide
CID 64782946

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(3-fluoro-4-hydroxyphenyl)pyridine-3-carboxamide?
The IUPAC name of 6-chloro-N-(3-fluoro-4-hydroxyphenyl)pyridine-3-carboxamide (CID 64782062) is 6-chloro-N-(3-fluoro-4-hydroxyphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-chloro-N-(3-fluoro-4-hydroxyphenyl)pyridine-3-carboxamide?
The canonical SMILES for 6-chloro-N-(3-fluoro-4-hydroxyphenyl)pyridine-3-carboxamide is O=C(Nc1ccc(O)c(F)c1)c1ccc(Cl)nc1.
What is the InChIKey of 6-chloro-N-(3-fluoro-4-hydroxyphenyl)pyridine-3-carboxamide?
The InChIKey is VQXJXNIIAYBWPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8ClFN2O2/c13-11-4-1-7(6-15-11)12(18)16-8-2-3-10(17)9(14)5-8/h1-6,17H,(H,16,18).
What are the key properties of 6-chloro-N-(3-fluoro-4-hydroxyphenyl)pyridine-3-carboxamide?
6-chloro-N-(3-fluoro-4-hydroxyphenyl)pyridine-3-carboxamide has a molecular weight of 266.66 g/mol, XLogP of 2.83, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(3-fluoro-4-hydroxyphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 64782062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).