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

C12H9FN2O2 — CID 63979934

IUPAC6-fluoro-N-(3-hydroxyphenyl)pyridine-3-carboxamide
SMILESO=C(Nc1cccc(O)c1)c1ccc(F)nc1
InChIInChI=1S/C12H9FN2O2/c13-11-5-4-8(7-14-11)12(17)15-9-2-1-3-10(16)6-9/h1-7,16H,(H,15,17)
InChIKeyRSIAKVIIXARNJB-UHFFFAOYSA-N
MW232.21 g/mol
LogP2.18
Rot. Bonds2

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

6-fluoro-N-(3-hydroxyphenyl)pyridine-3-carboxamide (PubChem CID 63979934) has the molecular formula C12H9FN2O2 and a molecular weight of 232.21 g/mol. Its IUPAC name is 6-fluoro-N-(3-hydroxyphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-fluoro-N-(3-hydroxyphenyl)pyridine-3-carboxamide
PubChem CID63979934
Molecular FormulaC12H9FN2O2
Molecular Weight232.21 g/mol
Exact Mass232.06
IUPAC Name6-fluoro-N-(3-hydroxyphenyl)pyridine-3-carboxamide
SMILESO=C(Nc1cccc(O)c1)c1ccc(F)nc1
InChIInChI=1S/C12H9FN2O2/c13-11-5-4-8(7-14-11)12(17)15-9-2-1-3-10(16)6-9/h1-7,16H,(H,15,17)
InChIKeyRSIAKVIIXARNJB-UHFFFAOYSA-N
XLogP2.18
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.21
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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-fluoro-N-(3-hydroxyphenyl)pyridine-3-carboxamide?
The IUPAC name of 6-fluoro-N-(3-hydroxyphenyl)pyridine-3-carboxamide (CID 63979934) is 6-fluoro-N-(3-hydroxyphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-fluoro-N-(3-hydroxyphenyl)pyridine-3-carboxamide?
The canonical SMILES for 6-fluoro-N-(3-hydroxyphenyl)pyridine-3-carboxamide is O=C(Nc1cccc(O)c1)c1ccc(F)nc1.
What is the InChIKey of 6-fluoro-N-(3-hydroxyphenyl)pyridine-3-carboxamide?
The InChIKey is RSIAKVIIXARNJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9FN2O2/c13-11-5-4-8(7-14-11)12(17)15-9-2-1-3-10(16)6-9/h1-7,16H,(H,15,17).
What are the key properties of 6-fluoro-N-(3-hydroxyphenyl)pyridine-3-carboxamide?
6-fluoro-N-(3-hydroxyphenyl)pyridine-3-carboxamide has a molecular weight of 232.21 g/mol, XLogP of 2.18, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-N-(3-hydroxyphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 63979934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).