6-fluoro-N-[2-(2-fluorophenyl)ethyl]pyridine-3-carboxamide

C14H12F2N2O — CID 63973138

IUPAC6-fluoro-N-[2-(2-fluorophenyl)ethyl]pyridine-3-carboxamide
SMILESO=C(NCCc1ccccc1F)c1ccc(F)nc1
InChIInChI=1S/C14H12F2N2O/c15-12-4-2-1-3-10(12)7-8-17-14(19)11-5-6-13(16)18-9-11/h1-6,9H,7-8H2,(H,17,19)
InChIKeyIDLMDXQWZWSGQX-UHFFFAOYSA-N
MW262.26 g/mol
LogP2.33
Rot. Bonds4

About 6-fluoro-N-[2-(2-fluorophenyl)ethyl]pyridine-3-carboxamide

6-fluoro-N-[2-(2-fluorophenyl)ethyl]pyridine-3-carboxamide (PubChem CID 63973138) has the molecular formula C14H12F2N2O and a molecular weight of 262.26 g/mol. Its IUPAC name is 6-fluoro-N-[2-(2-fluorophenyl)ethyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-fluoro-N-[2-(2-fluorophenyl)ethyl]pyridine-3-carboxamide
PubChem CID63973138
Molecular FormulaC14H12F2N2O
Molecular Weight262.26 g/mol
Exact Mass262.09
IUPAC Name6-fluoro-N-[2-(2-fluorophenyl)ethyl]pyridine-3-carboxamide
SMILESO=C(NCCc1ccccc1F)c1ccc(F)nc1
InChIInChI=1S/C14H12F2N2O/c15-12-4-2-1-3-10(12)7-8-17-14(19)11-5-6-13(16)18-9-11/h1-6,9H,7-8H2,(H,17,19)
InChIKeyIDLMDXQWZWSGQX-UHFFFAOYSA-N
XLogP2.33
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.26
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 6-fluoro-N-[2-(2-fluorophenyl)ethyl]pyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-(2-fluorophenyl)ethyl]-6-(methylamino)pyridine-3-carboxamide
CID 62171019
N-[2-(2-fluorophenyl)ethyl]-6-hydrazinylpyridine-3-carboxamide
CID 62236916
6-(butylamino)-N-[2-(2-fluorophenyl)ethyl]pyridine-3-carboxamide
CID 109151574
6-fluoro-N-(3-phenylpropyl)pyridine-3-carboxamide
CID 63972769
6-[(2-chlorophenyl)methylamino]-N-[2-(2-fluorophenyl)ethyl]pyridine-3-carboxamide
CID 109156772
4-bromo-N-[2-(2-fluorophenyl)ethyl]benzamide
CID 8636623
6-(3-fluoroanilino)-N-[2-(2-fluorophenyl)ethyl]pyridine-3-carboxamide
CID 109158603
N-(4-aminobutyl)-6-fluoropyridine-3-carboxamide
CID 63978211
2-(2-fluorophenyl)-N-[2-(2-fluorophenyl)ethyl]acetamide
CID 78792118
2-[2-(2-fluorophenyl)ethylamino]-N-propylpyrimidine-5-carboxamide
CID 109246508
6-fluoro-N-[2-(3-methylphenyl)ethyl]pyridine-3-carboxamide
CID 63978992
4-N-cyclopropyl-1-N-[2-(2-fluorophenyl)ethyl]benzene-1,4-dicarboxamide
CID 109043298

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-N-[2-(2-fluorophenyl)ethyl]pyridine-3-carboxamide?
The IUPAC name of 6-fluoro-N-[2-(2-fluorophenyl)ethyl]pyridine-3-carboxamide (CID 63973138) is 6-fluoro-N-[2-(2-fluorophenyl)ethyl]pyridine-3-carboxamide.
What is the SMILES notation for 6-fluoro-N-[2-(2-fluorophenyl)ethyl]pyridine-3-carboxamide?
The canonical SMILES for 6-fluoro-N-[2-(2-fluorophenyl)ethyl]pyridine-3-carboxamide is O=C(NCCc1ccccc1F)c1ccc(F)nc1.
What is the InChIKey of 6-fluoro-N-[2-(2-fluorophenyl)ethyl]pyridine-3-carboxamide?
The InChIKey is IDLMDXQWZWSGQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12F2N2O/c15-12-4-2-1-3-10(12)7-8-17-14(19)11-5-6-13(16)18-9-11/h1-6,9H,7-8H2,(H,17,19).
What are the key properties of 6-fluoro-N-[2-(2-fluorophenyl)ethyl]pyridine-3-carboxamide?
6-fluoro-N-[2-(2-fluorophenyl)ethyl]pyridine-3-carboxamide has a molecular weight of 262.26 g/mol, XLogP of 2.33, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-N-[2-(2-fluorophenyl)ethyl]pyridine-3-carboxamide is sourced from PubChem (CID 63973138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).