N-(2-ethylphenyl)-5-(2-fluoroanilino)pyridine-3-carboxamide

C20H18FN3O — CID 109243335

IUPACN-(2-ethylphenyl)-5-(2-fluoroanilino)pyridine-3-carboxamide
SMILESCCc1ccccc1NC(=O)c1cncc(Nc2ccccc2F)c1
InChIInChI=1S/C20H18FN3O/c1-2-14-7-3-5-9-18(14)24-20(25)15-11-16(13-22-12-15)23-19-10-6-4-8-17(19)21/h3-13,23H,2H2,1H3,(H,24,25)
InChIKeyAPWQCRIFGHCVLF-UHFFFAOYSA-N
MW335.38 g/mol
LogP4.78
Rot. Bonds5

About N-(2-ethylphenyl)-5-(2-fluoroanilino)pyridine-3-carboxamide

N-(2-ethylphenyl)-5-(2-fluoroanilino)pyridine-3-carboxamide (PubChem CID 109243335) has the molecular formula C20H18FN3O and a molecular weight of 335.38 g/mol. Its IUPAC name is N-(2-ethylphenyl)-5-(2-fluoroanilino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-ethylphenyl)-5-(2-fluoroanilino)pyridine-3-carboxamide
PubChem CID109243335
Molecular FormulaC20H18FN3O
Molecular Weight335.38 g/mol
Exact Mass335.14
IUPAC NameN-(2-ethylphenyl)-5-(2-fluoroanilino)pyridine-3-carboxamide
SMILESCCc1ccccc1NC(=O)c1cncc(Nc2ccccc2F)c1
InChIInChI=1S/C20H18FN3O/c1-2-14-7-3-5-9-18(14)24-20(25)15-11-16(13-22-12-15)23-19-10-6-4-8-17(19)21/h3-13,23H,2H2,1H3,(H,24,25)
InChIKeyAPWQCRIFGHCVLF-UHFFFAOYSA-N
XLogP4.78
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.38
LogP ≤ 54.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-(2-fluoroanilino)-N-propylpyridine-3-carboxamide
CID 109222874
5-N-(2-ethylphenyl)-3-N-[(2-fluorophenyl)methyl]pyridine-3,5-dicarboxamide
CID 109105539
5-(2,5-dimethylanilino)-N-(2-ethylphenyl)pyridine-3-carboxamide
CID 109242839
5-(3,4-dimethylanilino)-N-(2-ethylphenyl)pyridine-3-carboxamide
CID 109242952
N-(2-fluorophenyl)-5-(propylamino)pyridine-3-carboxamide
CID 109223073
N-(2,5-dimethylphenyl)-5-(2-ethylanilino)pyridine-3-carboxamide
CID 109242782
N-(2-ethylphenyl)-5-(quinolin-8-ylamino)pyridine-3-carboxamide
CID 109243373
5-(2,3-dimethylanilino)-N-(2-fluorophenyl)pyridine-3-carboxamide
CID 109243282
N-(3,4-dimethylphenyl)-5-(2-fluoroanilino)pyridine-3-carboxamide
CID 109242899
N-(3-acetylphenyl)-5-(2-ethylanilino)pyridine-3-carboxamide
CID 109243411
5-(2-ethylanilino)-N-(3-methylphenyl)pyridine-3-carboxamide
CID 109241836
5-[4-(dimethylamino)anilino]-N-(2-fluorophenyl)pyridine-3-carboxamide
CID 109244125

Frequently Asked Questions

What is the IUPAC name of N-(2-ethylphenyl)-5-(2-fluoroanilino)pyridine-3-carboxamide?
The IUPAC name of N-(2-ethylphenyl)-5-(2-fluoroanilino)pyridine-3-carboxamide (CID 109243335) is N-(2-ethylphenyl)-5-(2-fluoroanilino)pyridine-3-carboxamide.
What is the SMILES notation for N-(2-ethylphenyl)-5-(2-fluoroanilino)pyridine-3-carboxamide?
The canonical SMILES for N-(2-ethylphenyl)-5-(2-fluoroanilino)pyridine-3-carboxamide is CCc1ccccc1NC(=O)c1cncc(Nc2ccccc2F)c1.
What is the InChIKey of N-(2-ethylphenyl)-5-(2-fluoroanilino)pyridine-3-carboxamide?
The InChIKey is APWQCRIFGHCVLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18FN3O/c1-2-14-7-3-5-9-18(14)24-20(25)15-11-16(13-22-12-15)23-19-10-6-4-8-17(19)21/h3-13,23H,2H2,1H3,(H,24,25).
What are the key properties of N-(2-ethylphenyl)-5-(2-fluoroanilino)pyridine-3-carboxamide?
N-(2-ethylphenyl)-5-(2-fluoroanilino)pyridine-3-carboxamide has a molecular weight of 335.38 g/mol, XLogP of 4.78, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylphenyl)-5-(2-fluoroanilino)pyridine-3-carboxamide is sourced from PubChem (CID 109243335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).