5-(2-fluoroanilino)-N-propylpyridine-3-carboxamide

C15H16FN3O — CID 109222874

IUPAC5-(2-fluoroanilino)-N-propylpyridine-3-carboxamide
SMILESCCCNC(=O)c1cncc(Nc2ccccc2F)c1
InChIInChI=1S/C15H16FN3O/c1-2-7-18-15(20)11-8-12(10-17-9-11)19-14-6-4-3-5-13(14)16/h3-6,8-10,19H,2,7H2,1H3,(H,18,20)
InChIKeyQKHKIVBEFMFSJH-UHFFFAOYSA-N
MW273.31 g/mol
LogP3.10
Rot. Bonds5

About 5-(2-fluoroanilino)-N-propylpyridine-3-carboxamide

5-(2-fluoroanilino)-N-propylpyridine-3-carboxamide (PubChem CID 109222874) has the molecular formula C15H16FN3O and a molecular weight of 273.31 g/mol. Its IUPAC name is 5-(2-fluoroanilino)-N-propylpyridine-3-carboxamide.

Molecular Properties

Compound Name5-(2-fluoroanilino)-N-propylpyridine-3-carboxamide
PubChem CID109222874
Molecular FormulaC15H16FN3O
Molecular Weight273.31 g/mol
Exact Mass273.13
IUPAC Name5-(2-fluoroanilino)-N-propylpyridine-3-carboxamide
SMILESCCCNC(=O)c1cncc(Nc2ccccc2F)c1
InChIInChI=1S/C15H16FN3O/c1-2-7-18-15(20)11-8-12(10-17-9-11)19-14-6-4-3-5-13(14)16/h3-6,8-10,19H,2,7H2,1H3,(H,18,20)
InChIKeyQKHKIVBEFMFSJH-UHFFFAOYSA-N
XLogP3.10
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.31
LogP ≤ 53.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 5-(2-fluoroanilino)-N-propylpyridine-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-ethylphenyl)-5-(2-fluoroanilino)pyridine-3-carboxamide
CID 109243335
5-(2-propan-2-ylanilino)-N-propylpyridine-3-carboxamide
CID 109222867
N-(2-fluorophenyl)-5-(propylamino)pyridine-3-carboxamide
CID 109223073
5-(2-fluoroanilino)-N-(3-phenylpropyl)pyridine-3-carboxamide
CID 109239035
5-(2,3-dichloroanilino)-N-propylpyridine-3-carboxamide
CID 109222945
5-(2-fluoroanilino)pyridine-3-carboxylic acid
CID 82535090
N-(3,4-dimethylphenyl)-5-(2-fluoroanilino)pyridine-3-carboxamide
CID 109242899
5-(2,4-dichloroanilino)-N-propylpyridine-3-carboxamide
CID 109222941
5-(butylamino)-N-(2-fluorophenyl)pyridine-3-carboxamide
CID 109224645
N-cyclopentyl-5-(2-fluoroanilino)pyridine-3-carboxamide
CID 109225985
3-N-butyl-5-N-(2-fluorophenyl)pyridine-3,5-dicarboxamide
CID 109102018
5-(2-fluoroanilino)-N-(4-methoxyphenyl)pyridine-3-carboxamide
CID 109244174

Frequently Asked Questions

What is the IUPAC name of 5-(2-fluoroanilino)-N-propylpyridine-3-carboxamide?
The IUPAC name of 5-(2-fluoroanilino)-N-propylpyridine-3-carboxamide (CID 109222874) is 5-(2-fluoroanilino)-N-propylpyridine-3-carboxamide.
What is the SMILES notation for 5-(2-fluoroanilino)-N-propylpyridine-3-carboxamide?
The canonical SMILES for 5-(2-fluoroanilino)-N-propylpyridine-3-carboxamide is CCCNC(=O)c1cncc(Nc2ccccc2F)c1.
What is the InChIKey of 5-(2-fluoroanilino)-N-propylpyridine-3-carboxamide?
The InChIKey is QKHKIVBEFMFSJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FN3O/c1-2-7-18-15(20)11-8-12(10-17-9-11)19-14-6-4-3-5-13(14)16/h3-6,8-10,19H,2,7H2,1H3,(H,18,20).
What are the key properties of 5-(2-fluoroanilino)-N-propylpyridine-3-carboxamide?
5-(2-fluoroanilino)-N-propylpyridine-3-carboxamide has a molecular weight of 273.31 g/mol, XLogP of 3.10, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-fluoroanilino)-N-propylpyridine-3-carboxamide is sourced from PubChem (CID 109222874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).