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

C22H19N3O4 — CID 109093072

IUPAC2-N-(3-acetylphenyl)-4-N-(4-methoxyphenyl)pyridine-2,4-dicarboxamide
SMILESCOc1ccc(NC(=O)c2ccnc(C(=O)Nc3cccc(C(C)=O)c3)c2)cc1
InChIInChI=1S/C22H19N3O4/c1-14(26)15-4-3-5-18(12-15)25-22(28)20-13-16(10-11-23-20)21(27)24-17-6-8-19(29-2)9-7-17/h3-13H,1-2H3,(H,24,27)(H,25,28)
InChIKeyPXYJAIJFEJWNSD-UHFFFAOYSA-N
MW389.41 g/mol
LogP3.80
Rot. Bonds6

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

2-N-(3-acetylphenyl)-4-N-(4-methoxyphenyl)pyridine-2,4-dicarboxamide (PubChem CID 109093072) has the molecular formula C22H19N3O4 and a molecular weight of 389.41 g/mol. Its IUPAC name is 2-N-(3-acetylphenyl)-4-N-(4-methoxyphenyl)pyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name2-N-(3-acetylphenyl)-4-N-(4-methoxyphenyl)pyridine-2,4-dicarboxamide
PubChem CID109093072
Molecular FormulaC22H19N3O4
Molecular Weight389.41 g/mol
Exact Mass389.14
IUPAC Name2-N-(3-acetylphenyl)-4-N-(4-methoxyphenyl)pyridine-2,4-dicarboxamide
SMILESCOc1ccc(NC(=O)c2ccnc(C(=O)Nc3cccc(C(C)=O)c3)c2)cc1
InChIInChI=1S/C22H19N3O4/c1-14(26)15-4-3-5-18(12-15)25-22(28)20-13-16(10-11-23-20)21(27)24-17-6-8-19(29-2)9-7-17/h3-13H,1-2H3,(H,24,27)(H,25,28)
InChIKeyPXYJAIJFEJWNSD-UHFFFAOYSA-N
XLogP3.80
TPSA97.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.41
LogP ≤ 53.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-N-(3-acetylphenyl)-4-N-phenylpyridine-2,4-dicarboxamide
CID 109090859
4-N-(3-acetylphenyl)-2-N-(4-chlorophenyl)pyridine-2,4-dicarboxamide
CID 109092883
4-N-(4-chlorophenyl)-2-N-(4-methoxyphenyl)pyridine-2,4-dicarboxamide
CID 109092859
5-N-(3-acetylphenyl)-3-N-(4-methoxyphenyl)pyridine-3,5-dicarboxamide
CID 109108917
methyl 3-[[2-[(4-fluorophenyl)carbamoyl]pyridine-4-carbonyl]amino]benzoate
CID 109092752
2-N-(4-acetylphenyl)-4-N-(3-fluorophenyl)pyridine-2,4-dicarboxamide
CID 109093206
4-N-(3-chloro-4-methylphenyl)-2-N-(4-methoxyphenyl)pyridine-2,4-dicarboxamide
CID 109092947
4-N-(3-acetylphenyl)-2-N-tert-butylpyridine-2,4-dicarboxamide
CID 109089304
2-N-(4-methoxyphenyl)-4-N-quinolin-8-ylpyridine-2,4-dicarboxamide
CID 109093095
2-N-(4-cyanophenyl)-4-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide
CID 109093044
4-N-(3-chlorophenyl)-2-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide
CID 109092816
4-N-(4-acetamidophenyl)-2-N-(3-methylphenyl)pyridine-2,4-dicarboxamide
CID 109091241

Frequently Asked Questions

What is the IUPAC name of 2-N-(3-acetylphenyl)-4-N-(4-methoxyphenyl)pyridine-2,4-dicarboxamide?
The IUPAC name of 2-N-(3-acetylphenyl)-4-N-(4-methoxyphenyl)pyridine-2,4-dicarboxamide (CID 109093072) is 2-N-(3-acetylphenyl)-4-N-(4-methoxyphenyl)pyridine-2,4-dicarboxamide.
What is the SMILES notation for 2-N-(3-acetylphenyl)-4-N-(4-methoxyphenyl)pyridine-2,4-dicarboxamide?
The canonical SMILES for 2-N-(3-acetylphenyl)-4-N-(4-methoxyphenyl)pyridine-2,4-dicarboxamide is COc1ccc(NC(=O)c2ccnc(C(=O)Nc3cccc(C(C)=O)c3)c2)cc1.
What is the InChIKey of 2-N-(3-acetylphenyl)-4-N-(4-methoxyphenyl)pyridine-2,4-dicarboxamide?
The InChIKey is PXYJAIJFEJWNSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N3O4/c1-14(26)15-4-3-5-18(12-15)25-22(28)20-13-16(10-11-23-20)21(27)24-17-6-8-19(29-2)9-7-17/h3-13H,1-2H3,(H,24,27)(H,25,28).
What are the key properties of 2-N-(3-acetylphenyl)-4-N-(4-methoxyphenyl)pyridine-2,4-dicarboxamide?
2-N-(3-acetylphenyl)-4-N-(4-methoxyphenyl)pyridine-2,4-dicarboxamide has a molecular weight of 389.41 g/mol, XLogP of 3.80, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(3-acetylphenyl)-4-N-(4-methoxyphenyl)pyridine-2,4-dicarboxamide is sourced from PubChem (CID 109093072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).