2-N-(4-acetylphenyl)-4-N-(3-fluorophenyl)pyridine-2,4-dicarboxamide

C21H16FN3O3 — CID 109093206

IUPAC2-N-(4-acetylphenyl)-4-N-(3-fluorophenyl)pyridine-2,4-dicarboxamide
SMILESCC(=O)c1ccc(NC(=O)c2cc(C(=O)Nc3cccc(F)c3)ccn2)cc1
InChIInChI=1S/C21H16FN3O3/c1-13(26)14-5-7-17(8-6-14)24-21(28)19-11-15(9-10-23-19)20(27)25-18-4-2-3-16(22)12-18/h2-12H,1H3,(H,24,28)(H,25,27)
InChIKeySJJFBTDTPQCOBX-UHFFFAOYSA-N
MW377.38 g/mol
LogP3.93
Rot. Bonds5

About 2-N-(4-acetylphenyl)-4-N-(3-fluorophenyl)pyridine-2,4-dicarboxamide

2-N-(4-acetylphenyl)-4-N-(3-fluorophenyl)pyridine-2,4-dicarboxamide (PubChem CID 109093206) has the molecular formula C21H16FN3O3 and a molecular weight of 377.38 g/mol. Its IUPAC name is 2-N-(4-acetylphenyl)-4-N-(3-fluorophenyl)pyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name2-N-(4-acetylphenyl)-4-N-(3-fluorophenyl)pyridine-2,4-dicarboxamide
PubChem CID109093206
Molecular FormulaC21H16FN3O3
Molecular Weight377.38 g/mol
Exact Mass377.12
IUPAC Name2-N-(4-acetylphenyl)-4-N-(3-fluorophenyl)pyridine-2,4-dicarboxamide
SMILESCC(=O)c1ccc(NC(=O)c2cc(C(=O)Nc3cccc(F)c3)ccn2)cc1
InChIInChI=1S/C21H16FN3O3/c1-13(26)14-5-7-17(8-6-14)24-21(28)19-11-15(9-10-23-19)20(27)25-18-4-2-3-16(22)12-18/h2-12H,1H3,(H,24,28)(H,25,27)
InChIKeySJJFBTDTPQCOBX-UHFFFAOYSA-N
XLogP3.93
TPSA88.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.38
LogP ≤ 53.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-N-(3,4-difluorophenyl)-4-N-(3-fluorophenyl)pyridine-2,4-dicarboxamide
CID 109093279
2-N-(3-fluorophenyl)-4-N-(3-methylphenyl)pyridine-2,4-dicarboxamide
CID 109091177
2-N-(3-acetylphenyl)-4-N-phenylpyridine-2,4-dicarboxamide
CID 109090859
2-N-(3-chloro-4-fluorophenyl)-4-N-(3-fluorophenyl)pyridine-2,4-dicarboxamide
CID 109092972
4-N-(3-acetylphenyl)-2-N-(4-chlorophenyl)pyridine-2,4-dicarboxamide
CID 109092883
4-N-(4-acetylphenyl)-2-N-(2-fluorophenyl)pyridine-2,4-dicarboxamide
CID 109092659
4-N-(4-acetylphenyl)-2-N-(4-ethylphenyl)pyridine-2,4-dicarboxamide
CID 109092310
2-N-(3-fluorophenyl)-4-N-(2,4,6-trimethylphenyl)pyridine-2,4-dicarboxamide
CID 109092508
2-N-(3-acetylphenyl)-4-N-(4-methoxyphenyl)pyridine-2,4-dicarboxamide
CID 109093072
4-N-(4-acetamidophenyl)-2-N-(3-methylphenyl)pyridine-2,4-dicarboxamide
CID 109091241
methyl 3-[[2-[(4-fluorophenyl)carbamoyl]pyridine-4-carbonyl]amino]benzoate
CID 109092752
4-(3-acetylanilino)-N-(4-fluorophenyl)pyridine-2-carboxamide
CID 109220749

Frequently Asked Questions

What is the IUPAC name of 2-N-(4-acetylphenyl)-4-N-(3-fluorophenyl)pyridine-2,4-dicarboxamide?
The IUPAC name of 2-N-(4-acetylphenyl)-4-N-(3-fluorophenyl)pyridine-2,4-dicarboxamide (CID 109093206) is 2-N-(4-acetylphenyl)-4-N-(3-fluorophenyl)pyridine-2,4-dicarboxamide.
What is the SMILES notation for 2-N-(4-acetylphenyl)-4-N-(3-fluorophenyl)pyridine-2,4-dicarboxamide?
The canonical SMILES for 2-N-(4-acetylphenyl)-4-N-(3-fluorophenyl)pyridine-2,4-dicarboxamide is CC(=O)c1ccc(NC(=O)c2cc(C(=O)Nc3cccc(F)c3)ccn2)cc1.
What is the InChIKey of 2-N-(4-acetylphenyl)-4-N-(3-fluorophenyl)pyridine-2,4-dicarboxamide?
The InChIKey is SJJFBTDTPQCOBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16FN3O3/c1-13(26)14-5-7-17(8-6-14)24-21(28)19-11-15(9-10-23-19)20(27)25-18-4-2-3-16(22)12-18/h2-12H,1H3,(H,24,28)(H,25,27).
What are the key properties of 2-N-(4-acetylphenyl)-4-N-(3-fluorophenyl)pyridine-2,4-dicarboxamide?
2-N-(4-acetylphenyl)-4-N-(3-fluorophenyl)pyridine-2,4-dicarboxamide has a molecular weight of 377.38 g/mol, XLogP of 3.93, 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)-4-N-(3-fluorophenyl)pyridine-2,4-dicarboxamide is sourced from PubChem (CID 109093206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).