4-(3-acetamidoanilino)-N-(2-chlorophenyl)pyridine-2-carboxamide

C20H17ClN4O2 — CID 109220873

IUPAC4-(3-acetamidoanilino)-N-(2-chlorophenyl)pyridine-2-carboxamide
SMILESCC(=O)Nc1cccc(Nc2ccnc(C(=O)Nc3ccccc3Cl)c2)c1
InChIInChI=1S/C20H17ClN4O2/c1-13(26)23-14-5-4-6-15(11-14)24-16-9-10-22-19(12-16)20(27)25-18-8-3-2-7-17(18)21/h2-12H,1H3,(H,22,24)(H,23,26)(H,25,27)
InChIKeyVIFWTOXDCCSXBH-UHFFFAOYSA-N
MW380.84 g/mol
LogP4.69
Rot. Bonds5

About 4-(3-acetamidoanilino)-N-(2-chlorophenyl)pyridine-2-carboxamide

4-(3-acetamidoanilino)-N-(2-chlorophenyl)pyridine-2-carboxamide (PubChem CID 109220873) has the molecular formula C20H17ClN4O2 and a molecular weight of 380.84 g/mol. Its IUPAC name is 4-(3-acetamidoanilino)-N-(2-chlorophenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name4-(3-acetamidoanilino)-N-(2-chlorophenyl)pyridine-2-carboxamide
PubChem CID109220873
Molecular FormulaC20H17ClN4O2
Molecular Weight380.84 g/mol
Exact Mass380.10
IUPAC Name4-(3-acetamidoanilino)-N-(2-chlorophenyl)pyridine-2-carboxamide
SMILESCC(=O)Nc1cccc(Nc2ccnc(C(=O)Nc3ccccc3Cl)c2)c1
InChIInChI=1S/C20H17ClN4O2/c1-13(26)23-14-5-4-6-15(11-14)24-16-9-10-22-19(12-16)20(27)25-18-8-3-2-7-17(18)21/h2-12H,1H3,(H,22,24)(H,23,26)(H,25,27)
InChIKeyVIFWTOXDCCSXBH-UHFFFAOYSA-N
XLogP4.69
TPSA83.12 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.84
LogP ≤ 54.69
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 4-(3-acetamidoanilino)-N-(2-chlorophenyl)pyridine-2-carboxamide 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

N-(2-chlorophenyl)-4-(2,6-difluoroanilino)pyridine-2-carboxamide
CID 109220893
N-(2-chlorophenyl)-4-(4-ethoxyanilino)pyridine-2-carboxamide
CID 109220864
4-(3-acetylanilino)-N-(2-ethylphenyl)pyridine-2-carboxamide
CID 109220139
N-(2-chlorophenyl)-4-methylpyridine-2-carboxamide
CID 110858745
N-(3-acetylphenyl)-4-anilinopyridine-2-carboxamide
CID 109218881
4-(3-acetamidoanilino)-N-(2-phenylethyl)pyridine-2-carboxamide
CID 109213605
ethyl 2-[[2-[(2-chlorophenyl)carbamoyl]-4-pyridinyl]amino]benzoate
CID 109220888
methyl 3-[[2-[(3-chloro-2-methylphenyl)carbamoyl]-4-pyridinyl]amino]benzoate
CID 109221110
4-(3-acetamidoanilino)-N-cycloheptylpyridine-2-carboxamide
CID 109217101
N-(2-cyanophenyl)-4-(2,3-dichloroanilino)pyridine-2-carboxamide
CID 109222663
4-(4-cyanoanilino)-N-(2,3-dichlorophenyl)pyridine-2-carboxamide
CID 109222661
N-(2,4-dichlorophenyl)-4-(3-methoxyanilino)pyridine-2-carboxamide
CID 109221628

Frequently Asked Questions

What is the IUPAC name of 4-(3-acetamidoanilino)-N-(2-chlorophenyl)pyridine-2-carboxamide?
The IUPAC name of 4-(3-acetamidoanilino)-N-(2-chlorophenyl)pyridine-2-carboxamide (CID 109220873) is 4-(3-acetamidoanilino)-N-(2-chlorophenyl)pyridine-2-carboxamide.
What is the SMILES notation for 4-(3-acetamidoanilino)-N-(2-chlorophenyl)pyridine-2-carboxamide?
The canonical SMILES for 4-(3-acetamidoanilino)-N-(2-chlorophenyl)pyridine-2-carboxamide is CC(=O)Nc1cccc(Nc2ccnc(C(=O)Nc3ccccc3Cl)c2)c1.
What is the InChIKey of 4-(3-acetamidoanilino)-N-(2-chlorophenyl)pyridine-2-carboxamide?
The InChIKey is VIFWTOXDCCSXBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17ClN4O2/c1-13(26)23-14-5-4-6-15(11-14)24-16-9-10-22-19(12-16)20(27)25-18-8-3-2-7-17(18)21/h2-12H,1H3,(H,22,24)(H,23,26)(H,25,27).
What are the key properties of 4-(3-acetamidoanilino)-N-(2-chlorophenyl)pyridine-2-carboxamide?
4-(3-acetamidoanilino)-N-(2-chlorophenyl)pyridine-2-carboxamide has a molecular weight of 380.84 g/mol, XLogP of 4.69, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-acetamidoanilino)-N-(2-chlorophenyl)pyridine-2-carboxamide is sourced from PubChem (CID 109220873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).