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

C21H16ClN3O3 — CID 109092883

IUPAC4-N-(3-acetylphenyl)-2-N-(4-chlorophenyl)pyridine-2,4-dicarboxamide
SMILESCC(=O)c1cccc(NC(=O)c2ccnc(C(=O)Nc3ccc(Cl)cc3)c2)c1
InChIInChI=1S/C21H16ClN3O3/c1-13(26)14-3-2-4-18(11-14)25-20(27)15-9-10-23-19(12-15)21(28)24-17-7-5-16(22)6-8-17/h2-12H,1H3,(H,24,28)(H,25,27)
InChIKeyTWSCXFBRWDRCPC-UHFFFAOYSA-N
MW393.83 g/mol
LogP4.44
Rot. Bonds5

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

4-N-(3-acetylphenyl)-2-N-(4-chlorophenyl)pyridine-2,4-dicarboxamide (PubChem CID 109092883) has the molecular formula C21H16ClN3O3 and a molecular weight of 393.83 g/mol. Its IUPAC name is 4-N-(3-acetylphenyl)-2-N-(4-chlorophenyl)pyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name4-N-(3-acetylphenyl)-2-N-(4-chlorophenyl)pyridine-2,4-dicarboxamide
PubChem CID109092883
Molecular FormulaC21H16ClN3O3
Molecular Weight393.83 g/mol
Exact Mass393.09
IUPAC Name4-N-(3-acetylphenyl)-2-N-(4-chlorophenyl)pyridine-2,4-dicarboxamide
SMILESCC(=O)c1cccc(NC(=O)c2ccnc(C(=O)Nc3ccc(Cl)cc3)c2)c1
InChIInChI=1S/C21H16ClN3O3/c1-13(26)14-3-2-4-18(11-14)25-20(27)15-9-10-23-19(12-15)21(28)24-17-7-5-16(22)6-8-17/h2-12H,1H3,(H,24,28)(H,25,27)
InChIKeyTWSCXFBRWDRCPC-UHFFFAOYSA-N
XLogP4.44
TPSA88.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.83
LogP ≤ 54.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-N-(3-acetylphenyl)-2-N-(4-chlorophenyl)pyridine-2,4-dicarboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-N-(3-acetylphenyl)-4-N-phenylpyridine-2,4-dicarboxamide
CID 109090859
2-N-(3-acetylphenyl)-4-N-(4-methoxyphenyl)pyridine-2,4-dicarboxamide
CID 109093072
2-(3-acetylanilino)-N-(4-chlorophenyl)pyridine-4-carboxamide
CID 109177507
2-N-(4-acetylphenyl)-4-N-(3-fluorophenyl)pyridine-2,4-dicarboxamide
CID 109093206
6-N-(3-acetylphenyl)-2-N-(4-chlorophenyl)pyridine-2,6-dicarboxamide
CID 109100856
4-N-(3-acetylphenyl)-2-N-tert-butylpyridine-2,4-dicarboxamide
CID 109089304
4-N-(4-acetamidophenyl)-2-N-(3-methylphenyl)pyridine-2,4-dicarboxamide
CID 109091241
4-N-(4-chlorophenyl)-2-N-(4-propan-2-ylphenyl)pyridine-2,4-dicarboxamide
CID 109092487
4-N-(4-chlorophenyl)-2-N-(4-methoxyphenyl)pyridine-2,4-dicarboxamide
CID 109092859
2-N-(3-acetylphenyl)-4-N-(2-ethylphenyl)pyridine-2,4-dicarboxamide
CID 109092202
N-(3-acetylphenyl)-4-[(4-chlorophenyl)methylamino]pyridine-2-carboxamide
CID 109211919
4-N-(3-acetylphenyl)-2-N-cyclopentylpyridine-2,4-dicarboxamide
CID 109080981

Frequently Asked Questions

What is the IUPAC name of 4-N-(3-acetylphenyl)-2-N-(4-chlorophenyl)pyridine-2,4-dicarboxamide?
The IUPAC name of 4-N-(3-acetylphenyl)-2-N-(4-chlorophenyl)pyridine-2,4-dicarboxamide (CID 109092883) is 4-N-(3-acetylphenyl)-2-N-(4-chlorophenyl)pyridine-2,4-dicarboxamide.
What is the SMILES notation for 4-N-(3-acetylphenyl)-2-N-(4-chlorophenyl)pyridine-2,4-dicarboxamide?
The canonical SMILES for 4-N-(3-acetylphenyl)-2-N-(4-chlorophenyl)pyridine-2,4-dicarboxamide is CC(=O)c1cccc(NC(=O)c2ccnc(C(=O)Nc3ccc(Cl)cc3)c2)c1.
What is the InChIKey of 4-N-(3-acetylphenyl)-2-N-(4-chlorophenyl)pyridine-2,4-dicarboxamide?
The InChIKey is TWSCXFBRWDRCPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16ClN3O3/c1-13(26)14-3-2-4-18(11-14)25-20(27)15-9-10-23-19(12-15)21(28)24-17-7-5-16(22)6-8-17/h2-12H,1H3,(H,24,28)(H,25,27).
What are the key properties of 4-N-(3-acetylphenyl)-2-N-(4-chlorophenyl)pyridine-2,4-dicarboxamide?
4-N-(3-acetylphenyl)-2-N-(4-chlorophenyl)pyridine-2,4-dicarboxamide has a molecular weight of 393.83 g/mol, XLogP of 4.44, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(3-acetylphenyl)-2-N-(4-chlorophenyl)pyridine-2,4-dicarboxamide is sourced from PubChem (CID 109092883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).