2-fluoro-N-(2-phenylmethoxyphenyl)pyridine-3-carboxamide

C19H15FN2O2 — CID 59783787

IUPAC2-fluoro-N-(2-phenylmethoxyphenyl)pyridine-3-carboxamide
SMILESO=C(Nc1ccccc1OCc1ccccc1)c1cccnc1F
InChIInChI=1S/C19H15FN2O2/c20-18-15(9-6-12-21-18)19(23)22-16-10-4-5-11-17(16)24-13-14-7-2-1-3-8-14/h1-12H,13H2,(H,22,23)
InChIKeyFSEWWUFTOGVSDZ-UHFFFAOYSA-N
MW322.34 g/mol
LogP4.05
Rot. Bonds5

About 2-fluoro-N-(2-phenylmethoxyphenyl)pyridine-3-carboxamide

2-fluoro-N-(2-phenylmethoxyphenyl)pyridine-3-carboxamide (PubChem CID 59783787) has the molecular formula C19H15FN2O2 and a molecular weight of 322.34 g/mol. Its IUPAC name is 2-fluoro-N-(2-phenylmethoxyphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-fluoro-N-(2-phenylmethoxyphenyl)pyridine-3-carboxamide
PubChem CID59783787
Molecular FormulaC19H15FN2O2
Molecular Weight322.34 g/mol
Exact Mass322.11
IUPAC Name2-fluoro-N-(2-phenylmethoxyphenyl)pyridine-3-carboxamide
SMILESO=C(Nc1ccccc1OCc1ccccc1)c1cccnc1F
InChIInChI=1S/C19H15FN2O2/c20-18-15(9-6-12-21-18)19(23)22-16-10-4-5-11-17(16)24-13-14-7-2-1-3-8-14/h1-12H,13H2,(H,22,23)
InChIKeyFSEWWUFTOGVSDZ-UHFFFAOYSA-N
XLogP4.05
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.34
LogP ≤ 54.05
H-Bond Donors ≤ 51
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 2-fluoro-N-(2-phenylmethoxyphenyl)pyridine-3-carboxamide?
The IUPAC name of 2-fluoro-N-(2-phenylmethoxyphenyl)pyridine-3-carboxamide (CID 59783787) is 2-fluoro-N-(2-phenylmethoxyphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 2-fluoro-N-(2-phenylmethoxyphenyl)pyridine-3-carboxamide?
The canonical SMILES for 2-fluoro-N-(2-phenylmethoxyphenyl)pyridine-3-carboxamide is O=C(Nc1ccccc1OCc1ccccc1)c1cccnc1F.
What is the InChIKey of 2-fluoro-N-(2-phenylmethoxyphenyl)pyridine-3-carboxamide?
The InChIKey is FSEWWUFTOGVSDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15FN2O2/c20-18-15(9-6-12-21-18)19(23)22-16-10-4-5-11-17(16)24-13-14-7-2-1-3-8-14/h1-12H,13H2,(H,22,23).
What are the key properties of 2-fluoro-N-(2-phenylmethoxyphenyl)pyridine-3-carboxamide?
2-fluoro-N-(2-phenylmethoxyphenyl)pyridine-3-carboxamide has a molecular weight of 322.34 g/mol, XLogP of 4.05, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-(2-phenylmethoxyphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 59783787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).