2-fluoro-N-(4-hydroxyphenyl)pyridine-4-carboxamide

C12H9FN2O2 — CID 61294384

IUPAC2-fluoro-N-(4-hydroxyphenyl)pyridine-4-carboxamide
SMILESO=C(Nc1ccc(O)cc1)c1ccnc(F)c1
InChIInChI=1S/C12H9FN2O2/c13-11-7-8(5-6-14-11)12(17)15-9-1-3-10(16)4-2-9/h1-7,16H,(H,15,17)
InChIKeyVNKAIDJVXRKIAR-UHFFFAOYSA-N
MW232.21 g/mol
LogP2.18
Rot. Bonds2

About 2-fluoro-N-(4-hydroxyphenyl)pyridine-4-carboxamide

2-fluoro-N-(4-hydroxyphenyl)pyridine-4-carboxamide (PubChem CID 61294384) has the molecular formula C12H9FN2O2 and a molecular weight of 232.21 g/mol. Its IUPAC name is 2-fluoro-N-(4-hydroxyphenyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-fluoro-N-(4-hydroxyphenyl)pyridine-4-carboxamide
PubChem CID61294384
Molecular FormulaC12H9FN2O2
Molecular Weight232.21 g/mol
Exact Mass232.06
IUPAC Name2-fluoro-N-(4-hydroxyphenyl)pyridine-4-carboxamide
SMILESO=C(Nc1ccc(O)cc1)c1ccnc(F)c1
InChIInChI=1S/C12H9FN2O2/c13-11-7-8(5-6-14-11)12(17)15-9-1-3-10(16)4-2-9/h1-7,16H,(H,15,17)
InChIKeyVNKAIDJVXRKIAR-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'}, {'alert_name': 'hydroquinone', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-(4-hydroxyphenyl)pyridine-4-carboxamide?
The IUPAC name of 2-fluoro-N-(4-hydroxyphenyl)pyridine-4-carboxamide (CID 61294384) is 2-fluoro-N-(4-hydroxyphenyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-fluoro-N-(4-hydroxyphenyl)pyridine-4-carboxamide?
The canonical SMILES for 2-fluoro-N-(4-hydroxyphenyl)pyridine-4-carboxamide is O=C(Nc1ccc(O)cc1)c1ccnc(F)c1.
What is the InChIKey of 2-fluoro-N-(4-hydroxyphenyl)pyridine-4-carboxamide?
The InChIKey is VNKAIDJVXRKIAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9FN2O2/c13-11-7-8(5-6-14-11)12(17)15-9-1-3-10(16)4-2-9/h1-7,16H,(H,15,17).
What are the key properties of 2-fluoro-N-(4-hydroxyphenyl)pyridine-4-carboxamide?
2-fluoro-N-(4-hydroxyphenyl)pyridine-4-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 2-fluoro-N-(4-hydroxyphenyl)pyridine-4-carboxamide is sourced from PubChem (CID 61294384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).