N-(2,4-dimethylphenyl)-5-(2-fluoroanilino)pyridine-2-carboxamide

C20H18FN3O — CID 109197955

IUPACN-(2,4-dimethylphenyl)-5-(2-fluoroanilino)pyridine-2-carboxamide
SMILESCc1ccc(NC(=O)c2ccc(Nc3ccccc3F)cn2)c(C)c1
InChIInChI=1S/C20H18FN3O/c1-13-7-9-17(14(2)11-13)24-20(25)19-10-8-15(12-22-19)23-18-6-4-3-5-16(18)21/h3-12,23H,1-2H3,(H,24,25)
InChIKeyBAZXRKOTRHKXON-UHFFFAOYSA-N
MW335.38 g/mol
LogP4.83
Rot. Bonds4

About N-(2,4-dimethylphenyl)-5-(2-fluoroanilino)pyridine-2-carboxamide

N-(2,4-dimethylphenyl)-5-(2-fluoroanilino)pyridine-2-carboxamide (PubChem CID 109197955) has the molecular formula C20H18FN3O and a molecular weight of 335.38 g/mol. Its IUPAC name is N-(2,4-dimethylphenyl)-5-(2-fluoroanilino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2,4-dimethylphenyl)-5-(2-fluoroanilino)pyridine-2-carboxamide
PubChem CID109197955
Molecular FormulaC20H18FN3O
Molecular Weight335.38 g/mol
Exact Mass335.14
IUPAC NameN-(2,4-dimethylphenyl)-5-(2-fluoroanilino)pyridine-2-carboxamide
SMILESCc1ccc(NC(=O)c2ccc(Nc3ccccc3F)cn2)c(C)c1
InChIInChI=1S/C20H18FN3O/c1-13-7-9-17(14(2)11-13)24-20(25)19-10-8-15(12-22-19)23-18-6-4-3-5-16(18)21/h3-12,23H,1-2H3,(H,24,25)
InChIKeyBAZXRKOTRHKXON-UHFFFAOYSA-N
XLogP4.83
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.38
LogP ≤ 54.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-anilino-N-(2,4-dimethylphenyl)pyridine-2-carboxamide
CID 109197061
N-(2,4-difluorophenyl)-5-(2,4-dimethylanilino)pyridine-2-carboxamide
CID 109198012
5-(2,5-dimethylanilino)-N-(2-methylphenyl)pyridine-2-carboxamide
CID 109197157
N-(2-fluorophenyl)-5-(2-methoxy-5-methylanilino)pyridine-2-carboxamide
CID 109198831
N-(2,4-dichlorophenyl)-5-(2-fluoroanilino)pyridine-2-carboxamide
CID 109198930
N-(2,4-dimethylphenyl)-2-(2-fluoroanilino)pyrimidine-5-carboxamide
CID 109266385
N-(2,4-dimethylphenyl)-5-(ethylamino)pyridine-2-carboxamide
CID 104639949
5-(4-fluoroanilino)-N-(2-methylphenyl)pyridine-2-carboxamide
CID 109197166
N-(4-acetylphenyl)-5-(2-fluoroanilino)pyridine-2-carboxamide
CID 109198907
4-N-(2,4-dimethylphenyl)-2-N-(2-fluorophenyl)pyridine-2,4-dicarboxamide
CID 109091713
N-tert-butyl-5-(2-fluoroanilino)pyridine-2-carboxamide
CID 109195085
N-(2-fluorophenyl)-5-(2-propan-2-ylanilino)pyridine-2-carboxamide
CID 109198647

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethylphenyl)-5-(2-fluoroanilino)pyridine-2-carboxamide?
The IUPAC name of N-(2,4-dimethylphenyl)-5-(2-fluoroanilino)pyridine-2-carboxamide (CID 109197955) is N-(2,4-dimethylphenyl)-5-(2-fluoroanilino)pyridine-2-carboxamide.
What is the SMILES notation for N-(2,4-dimethylphenyl)-5-(2-fluoroanilino)pyridine-2-carboxamide?
The canonical SMILES for N-(2,4-dimethylphenyl)-5-(2-fluoroanilino)pyridine-2-carboxamide is Cc1ccc(NC(=O)c2ccc(Nc3ccccc3F)cn2)c(C)c1.
What is the InChIKey of N-(2,4-dimethylphenyl)-5-(2-fluoroanilino)pyridine-2-carboxamide?
The InChIKey is BAZXRKOTRHKXON-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18FN3O/c1-13-7-9-17(14(2)11-13)24-20(25)19-10-8-15(12-22-19)23-18-6-4-3-5-16(18)21/h3-12,23H,1-2H3,(H,24,25).
What are the key properties of N-(2,4-dimethylphenyl)-5-(2-fluoroanilino)pyridine-2-carboxamide?
N-(2,4-dimethylphenyl)-5-(2-fluoroanilino)pyridine-2-carboxamide has a molecular weight of 335.38 g/mol, XLogP of 4.83, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethylphenyl)-5-(2-fluoroanilino)pyridine-2-carboxamide is sourced from PubChem (CID 109197955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).