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

C20H16F2N4O2 — CID 109178580

IUPACN-(4-acetamidophenyl)-2-(2,6-difluoroanilino)pyridine-4-carboxamide
SMILESCC(=O)Nc1ccc(NC(=O)c2ccnc(Nc3c(F)cccc3F)c2)cc1
InChIInChI=1S/C20H16F2N4O2/c1-12(27)24-14-5-7-15(8-6-14)25-20(28)13-9-10-23-18(11-13)26-19-16(21)3-2-4-17(19)22/h2-11H,1H3,(H,23,26)(H,24,27)(H,25,28)
InChIKeyXXWLIHDRHBWQSE-UHFFFAOYSA-N
MW382.37 g/mol
LogP4.31
Rot. Bonds5

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

N-(4-acetamidophenyl)-2-(2,6-difluoroanilino)pyridine-4-carboxamide (PubChem CID 109178580) has the molecular formula C20H16F2N4O2 and a molecular weight of 382.37 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-2-(2,6-difluoroanilino)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(4-acetamidophenyl)-2-(2,6-difluoroanilino)pyridine-4-carboxamide
PubChem CID109178580
Molecular FormulaC20H16F2N4O2
Molecular Weight382.37 g/mol
Exact Mass382.12
IUPAC NameN-(4-acetamidophenyl)-2-(2,6-difluoroanilino)pyridine-4-carboxamide
SMILESCC(=O)Nc1ccc(NC(=O)c2ccnc(Nc3c(F)cccc3F)c2)cc1
InChIInChI=1S/C20H16F2N4O2/c1-12(27)24-14-5-7-15(8-6-14)25-20(28)13-9-10-23-18(11-13)26-19-16(21)3-2-4-17(19)22/h2-11H,1H3,(H,23,26)(H,24,27)(H,25,28)
InChIKeyXXWLIHDRHBWQSE-UHFFFAOYSA-N
XLogP4.31
TPSA83.12 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.37
LogP ≤ 54.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2,6-difluoroanilino)-N-(4-ethylphenyl)pyridine-4-carboxamide
CID 109176900
methyl 4-[[2-(2,6-difluoroanilino)pyridine-4-carbonyl]amino]benzoate
CID 109178658
2-(4-acetamidoanilino)-N-(4-methylphenyl)pyridine-4-carboxamide
CID 109176294
N-(3-acetamidophenyl)-2-(4-acetylanilino)pyridine-4-carboxamide
CID 109178526
2-(3-acetamidoanilino)-N-(4-methoxyphenyl)pyridine-4-carboxamide
CID 109178041
2-(4-cyanoanilino)-N-(2,6-difluorophenyl)pyridine-4-carboxamide
CID 109179026
N-[4-[[4-(2,6-difluoroanilino)pyrimidin-2-yl]amino]phenyl]acetamide
CID 112905840
N-(2,6-difluorophenyl)-2-(3-methoxyanilino)pyridine-4-carboxamide
CID 109178031
N-(4-acetamidophenyl)-2-(2-methoxyanilino)pyridine-4-carboxamide
CID 109177925
2-(3-acetylanilino)-N-(4-chlorophenyl)pyridine-4-carboxamide
CID 109177507
N-(3-acetamidophenyl)-2-[(2-fluorophenyl)methylamino]pyridine-4-carboxamide
CID 109170520
2-(3-acetamidoanilino)-N-(2,6-dimethylphenyl)pyridine-4-carboxamide
CID 109176756

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-2-(2,6-difluoroanilino)pyridine-4-carboxamide?
The IUPAC name of N-(4-acetamidophenyl)-2-(2,6-difluoroanilino)pyridine-4-carboxamide (CID 109178580) is N-(4-acetamidophenyl)-2-(2,6-difluoroanilino)pyridine-4-carboxamide.
What is the SMILES notation for N-(4-acetamidophenyl)-2-(2,6-difluoroanilino)pyridine-4-carboxamide?
The canonical SMILES for N-(4-acetamidophenyl)-2-(2,6-difluoroanilino)pyridine-4-carboxamide is CC(=O)Nc1ccc(NC(=O)c2ccnc(Nc3c(F)cccc3F)c2)cc1.
What is the InChIKey of N-(4-acetamidophenyl)-2-(2,6-difluoroanilino)pyridine-4-carboxamide?
The InChIKey is XXWLIHDRHBWQSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16F2N4O2/c1-12(27)24-14-5-7-15(8-6-14)25-20(28)13-9-10-23-18(11-13)26-19-16(21)3-2-4-17(19)22/h2-11H,1H3,(H,23,26)(H,24,27)(H,25,28).
What are the key properties of N-(4-acetamidophenyl)-2-(2,6-difluoroanilino)pyridine-4-carboxamide?
N-(4-acetamidophenyl)-2-(2,6-difluoroanilino)pyridine-4-carboxamide has a molecular weight of 382.37 g/mol, XLogP of 4.31, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamidophenyl)-2-(2,6-difluoroanilino)pyridine-4-carboxamide is sourced from PubChem (CID 109178580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).