2-(2,6-difluoroanilino)-N-(4-ethylphenyl)pyridine-4-carboxamide

C20H17F2N3O — CID 109176900

IUPAC2-(2,6-difluoroanilino)-N-(4-ethylphenyl)pyridine-4-carboxamide
SMILESCCc1ccc(NC(=O)c2ccnc(Nc3c(F)cccc3F)c2)cc1
InChIInChI=1S/C20H17F2N3O/c1-2-13-6-8-15(9-7-13)24-20(26)14-10-11-23-18(12-14)25-19-16(21)4-3-5-17(19)22/h3-12H,2H2,1H3,(H,23,25)(H,24,26)
InChIKeyLOBAUZAPNNOJAF-UHFFFAOYSA-N
MW353.37 g/mol
LogP4.92
Rot. Bonds5

About 2-(2,6-difluoroanilino)-N-(4-ethylphenyl)pyridine-4-carboxamide

2-(2,6-difluoroanilino)-N-(4-ethylphenyl)pyridine-4-carboxamide (PubChem CID 109176900) has the molecular formula C20H17F2N3O and a molecular weight of 353.37 g/mol. Its IUPAC name is 2-(2,6-difluoroanilino)-N-(4-ethylphenyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-(2,6-difluoroanilino)-N-(4-ethylphenyl)pyridine-4-carboxamide
PubChem CID109176900
Molecular FormulaC20H17F2N3O
Molecular Weight353.37 g/mol
Exact Mass353.13
IUPAC Name2-(2,6-difluoroanilino)-N-(4-ethylphenyl)pyridine-4-carboxamide
SMILESCCc1ccc(NC(=O)c2ccnc(Nc3c(F)cccc3F)c2)cc1
InChIInChI=1S/C20H17F2N3O/c1-2-13-6-8-15(9-7-13)24-20(26)14-10-11-23-18(12-14)25-19-16(21)4-3-5-17(19)22/h3-12H,2H2,1H3,(H,23,25)(H,24,26)
InChIKeyLOBAUZAPNNOJAF-UHFFFAOYSA-N
XLogP4.92
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.37
LogP ≤ 54.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-acetamidophenyl)-2-(2,6-difluoroanilino)pyridine-4-carboxamide
CID 109178580
methyl 4-[[2-(2,6-difluoroanilino)pyridine-4-carbonyl]amino]benzoate
CID 109178658
2-(2,4-difluoroanilino)-N-(4-ethylphenyl)pyridine-4-carboxamide
CID 109176898
N-(4-ethylphenyl)-2-[2-(2-fluorophenyl)ethylamino]pyridine-4-carboxamide
CID 109172552
ethyl 4-[[2-(4-ethylanilino)pyridine-4-carbonyl]amino]benzoate
CID 109176919
2-(2,6-difluoroanilino)-N-[(4-fluorophenyl)methyl]pyridine-4-carboxamide
CID 109170627
6-(2,6-difluoroanilino)-N-(4-ethylphenyl)pyridazine-3-carboxamide
CID 109128021
2-(3-ethylanilino)-N-(4-methoxyphenyl)pyridine-4-carboxamide
CID 46283332
2-N-(3,4-difluorophenyl)-4-N-(4-ethylphenyl)pyridine-2,4-dicarboxamide
CID 109092288
2-bromo-N-(4-ethylphenyl)pyridine-4-carboxamide
CID 113255068
N-(4-ethylphenyl)-2-(2-methoxy-5-methylanilino)pyridine-4-carboxamide
CID 109176882
2-(4-cyanoanilino)-N-(2,6-difluorophenyl)pyridine-4-carboxamide
CID 109179026

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-difluoroanilino)-N-(4-ethylphenyl)pyridine-4-carboxamide?
The IUPAC name of 2-(2,6-difluoroanilino)-N-(4-ethylphenyl)pyridine-4-carboxamide (CID 109176900) is 2-(2,6-difluoroanilino)-N-(4-ethylphenyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-(2,6-difluoroanilino)-N-(4-ethylphenyl)pyridine-4-carboxamide?
The canonical SMILES for 2-(2,6-difluoroanilino)-N-(4-ethylphenyl)pyridine-4-carboxamide is CCc1ccc(NC(=O)c2ccnc(Nc3c(F)cccc3F)c2)cc1.
What is the InChIKey of 2-(2,6-difluoroanilino)-N-(4-ethylphenyl)pyridine-4-carboxamide?
The InChIKey is LOBAUZAPNNOJAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17F2N3O/c1-2-13-6-8-15(9-7-13)24-20(26)14-10-11-23-18(12-14)25-19-16(21)4-3-5-17(19)22/h3-12H,2H2,1H3,(H,23,25)(H,24,26).
What are the key properties of 2-(2,6-difluoroanilino)-N-(4-ethylphenyl)pyridine-4-carboxamide?
2-(2,6-difluoroanilino)-N-(4-ethylphenyl)pyridine-4-carboxamide has a molecular weight of 353.37 g/mol, XLogP of 4.92, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-difluoroanilino)-N-(4-ethylphenyl)pyridine-4-carboxamide is sourced from PubChem (CID 109176900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).