2-N-(4-acetylphenyl)-6-N-(2,4-difluorophenyl)pyridine-2,6-dicarboxamide

C21H15F2N3O3 — CID 109101020

IUPAC2-N-(4-acetylphenyl)-6-N-(2,4-difluorophenyl)pyridine-2,6-dicarboxamide
SMILESCC(=O)c1ccc(NC(=O)c2cccc(C(=O)Nc3ccc(F)cc3F)n2)cc1
InChIInChI=1S/C21H15F2N3O3/c1-12(27)13-5-8-15(9-6-13)24-20(28)18-3-2-4-19(25-18)21(29)26-17-10-7-14(22)11-16(17)23/h2-11H,1H3,(H,24,28)(H,26,29)
InChIKeySKDJJDJWUMBSRS-UHFFFAOYSA-N
MW395.37 g/mol
LogP4.07
Rot. Bonds5

About 2-N-(4-acetylphenyl)-6-N-(2,4-difluorophenyl)pyridine-2,6-dicarboxamide

2-N-(4-acetylphenyl)-6-N-(2,4-difluorophenyl)pyridine-2,6-dicarboxamide (PubChem CID 109101020) has the molecular formula C21H15F2N3O3 and a molecular weight of 395.37 g/mol. Its IUPAC name is 2-N-(4-acetylphenyl)-6-N-(2,4-difluorophenyl)pyridine-2,6-dicarboxamide.

Molecular Properties

Compound Name2-N-(4-acetylphenyl)-6-N-(2,4-difluorophenyl)pyridine-2,6-dicarboxamide
PubChem CID109101020
Molecular FormulaC21H15F2N3O3
Molecular Weight395.37 g/mol
Exact Mass395.11
IUPAC Name2-N-(4-acetylphenyl)-6-N-(2,4-difluorophenyl)pyridine-2,6-dicarboxamide
SMILESCC(=O)c1ccc(NC(=O)c2cccc(C(=O)Nc3ccc(F)cc3F)n2)cc1
InChIInChI=1S/C21H15F2N3O3/c1-12(27)13-5-8-15(9-6-13)24-20(28)18-3-2-4-19(25-18)21(29)26-17-10-7-14(22)11-16(17)23/h2-11H,1H3,(H,24,28)(H,26,29)
InChIKeySKDJJDJWUMBSRS-UHFFFAOYSA-N
XLogP4.07
TPSA88.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.37
LogP ≤ 54.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-N-(2,4-difluorophenyl)-2-N-phenylpyridine-2,6-dicarboxamide
CID 109100019
6-N-(2,4-difluorophenyl)-2-N-(3,4-difluorophenyl)pyridine-2,6-dicarboxamide
CID 109101086
2-N-(4-acetylphenyl)-6-N-(2-methylphenyl)pyridine-2,6-dicarboxamide
CID 109100082
2-N-(4-acetylphenyl)-6-N-(2-methoxyphenyl)pyridine-2,6-dicarboxamide
CID 109100922
2-N-(2,4-difluorophenyl)-6-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2,6-dicarboxamide
CID 109101087
6-N-(2,4-difluorophenyl)-2-N-(2-methoxyethyl)pyridine-2,6-dicarboxamide
CID 109095796
2-N-(3-acetylphenyl)-6-N-(3,4-difluorophenyl)pyridine-2,6-dicarboxamide
CID 109101017
2-N,6-N-bis(4-chloro-2-fluorophenyl)pyridine-2,6-dicarboxamide
CID 3352552
1-[4-(2,4-difluoroanilino)phenyl]ethanone
CID 82536666
2-N-(4-acetylphenyl)-6-N-(2-cyanophenyl)pyridine-2,6-dicarboxamide
CID 109101022
6-N-(3-acetylphenyl)-2-N-(4-chlorophenyl)pyridine-2,6-dicarboxamide
CID 109100856
6-(4-acetylanilino)-N-(2,4-difluorophenyl)pyridine-3-carboxamide
CID 109164503

Frequently Asked Questions

What is the IUPAC name of 2-N-(4-acetylphenyl)-6-N-(2,4-difluorophenyl)pyridine-2,6-dicarboxamide?
The IUPAC name of 2-N-(4-acetylphenyl)-6-N-(2,4-difluorophenyl)pyridine-2,6-dicarboxamide (CID 109101020) is 2-N-(4-acetylphenyl)-6-N-(2,4-difluorophenyl)pyridine-2,6-dicarboxamide.
What is the SMILES notation for 2-N-(4-acetylphenyl)-6-N-(2,4-difluorophenyl)pyridine-2,6-dicarboxamide?
The canonical SMILES for 2-N-(4-acetylphenyl)-6-N-(2,4-difluorophenyl)pyridine-2,6-dicarboxamide is CC(=O)c1ccc(NC(=O)c2cccc(C(=O)Nc3ccc(F)cc3F)n2)cc1.
What is the InChIKey of 2-N-(4-acetylphenyl)-6-N-(2,4-difluorophenyl)pyridine-2,6-dicarboxamide?
The InChIKey is SKDJJDJWUMBSRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H15F2N3O3/c1-12(27)13-5-8-15(9-6-13)24-20(28)18-3-2-4-19(25-18)21(29)26-17-10-7-14(22)11-16(17)23/h2-11H,1H3,(H,24,28)(H,26,29).
What are the key properties of 2-N-(4-acetylphenyl)-6-N-(2,4-difluorophenyl)pyridine-2,6-dicarboxamide?
2-N-(4-acetylphenyl)-6-N-(2,4-difluorophenyl)pyridine-2,6-dicarboxamide has a molecular weight of 395.37 g/mol, XLogP of 4.07, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(4-acetylphenyl)-6-N-(2,4-difluorophenyl)pyridine-2,6-dicarboxamide is sourced from PubChem (CID 109101020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).