6-(4-acetylanilino)-N-(2,4-difluorophenyl)pyridine-3-carboxamide

C20H15F2N3O2 — CID 109164503

IUPAC6-(4-acetylanilino)-N-(2,4-difluorophenyl)pyridine-3-carboxamide
SMILESCC(=O)c1ccc(Nc2ccc(C(=O)Nc3ccc(F)cc3F)cn2)cc1
InChIInChI=1S/C20H15F2N3O2/c1-12(26)13-2-6-16(7-3-13)24-19-9-4-14(11-23-19)20(27)25-18-8-5-15(21)10-17(18)22/h2-11H,1H3,(H,23,24)(H,25,27)
InChIKeyYMXJTPRRQSVJQK-UHFFFAOYSA-N
MW367.36 g/mol
LogP4.56
Rot. Bonds5

About 6-(4-acetylanilino)-N-(2,4-difluorophenyl)pyridine-3-carboxamide

6-(4-acetylanilino)-N-(2,4-difluorophenyl)pyridine-3-carboxamide (PubChem CID 109164503) has the molecular formula C20H15F2N3O2 and a molecular weight of 367.36 g/mol. Its IUPAC name is 6-(4-acetylanilino)-N-(2,4-difluorophenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(4-acetylanilino)-N-(2,4-difluorophenyl)pyridine-3-carboxamide
PubChem CID109164503
Molecular FormulaC20H15F2N3O2
Molecular Weight367.36 g/mol
Exact Mass367.11
IUPAC Name6-(4-acetylanilino)-N-(2,4-difluorophenyl)pyridine-3-carboxamide
SMILESCC(=O)c1ccc(Nc2ccc(C(=O)Nc3ccc(F)cc3F)cn2)cc1
InChIInChI=1S/C20H15F2N3O2/c1-12(26)13-2-6-16(7-3-13)24-19-9-4-14(11-23-19)20(27)25-18-8-5-15(21)10-17(18)22/h2-11H,1H3,(H,23,24)(H,25,27)
InChIKeyYMXJTPRRQSVJQK-UHFFFAOYSA-N
XLogP4.56
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.36
LogP ≤ 54.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[6-(4-acetylanilino)-3-pyridinyl]-4-fluorobenzamide
CID 113020400
N-(2,4-difluorophenyl)-6-(2,4-dimethylanilino)pyridine-3-carboxamide
CID 109162562
6-(4-acetamidoanilino)-N-(4-fluorophenyl)pyridine-3-carboxamide
CID 109163310
1-[4-(2,4-difluoroanilino)phenyl]ethanone
CID 82536666
N-[6-(2,4-difluoroanilino)-3-pyridinyl]acetamide
CID 113021840
6-(4-acetylanilino)-N-(3,5-dimethylphenyl)pyridine-3-carboxamide
CID 109162705
6-(4-acetamidoanilino)-N-(3-fluorophenyl)pyridine-3-carboxamide
CID 109164557
ethyl 2-[[5-[(2,4-difluorophenyl)carbamoyl]-2-pyridinyl]amino]benzoate
CID 109164884
N-[6-(2,4-difluoroanilino)-3-pyridinyl]-3-fluorobenzamide
CID 113021858
2-N-(4-acetylphenyl)-6-N-(2,4-difluorophenyl)pyridine-2,6-dicarboxamide
CID 109101020
6-(4-acetylanilino)-N-(3-chloro-2-methylphenyl)pyridine-3-carboxamide
CID 109163558
1-N,4-N-bis(2,4-difluorophenyl)benzene-1,4-dicarboxamide
CID 3596826

Frequently Asked Questions

What is the IUPAC name of 6-(4-acetylanilino)-N-(2,4-difluorophenyl)pyridine-3-carboxamide?
The IUPAC name of 6-(4-acetylanilino)-N-(2,4-difluorophenyl)pyridine-3-carboxamide (CID 109164503) is 6-(4-acetylanilino)-N-(2,4-difluorophenyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-(4-acetylanilino)-N-(2,4-difluorophenyl)pyridine-3-carboxamide?
The canonical SMILES for 6-(4-acetylanilino)-N-(2,4-difluorophenyl)pyridine-3-carboxamide is CC(=O)c1ccc(Nc2ccc(C(=O)Nc3ccc(F)cc3F)cn2)cc1.
What is the InChIKey of 6-(4-acetylanilino)-N-(2,4-difluorophenyl)pyridine-3-carboxamide?
The InChIKey is YMXJTPRRQSVJQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15F2N3O2/c1-12(26)13-2-6-16(7-3-13)24-19-9-4-14(11-23-19)20(27)25-18-8-5-15(21)10-17(18)22/h2-11H,1H3,(H,23,24)(H,25,27).
What are the key properties of 6-(4-acetylanilino)-N-(2,4-difluorophenyl)pyridine-3-carboxamide?
6-(4-acetylanilino)-N-(2,4-difluorophenyl)pyridine-3-carboxamide has a molecular weight of 367.36 g/mol, XLogP of 4.56, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-acetylanilino)-N-(2,4-difluorophenyl)pyridine-3-carboxamide is sourced from PubChem (CID 109164503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).