6-[(4-chlorophenyl)methylamino]-N-(2-cyanophenyl)pyridine-3-carboxamide

C20H15ClN4O — CID 109156965

IUPAC6-[(4-chlorophenyl)methylamino]-N-(2-cyanophenyl)pyridine-3-carboxamide
SMILESN#Cc1ccccc1NC(=O)c1ccc(NCc2ccc(Cl)cc2)nc1
InChIInChI=1S/C20H15ClN4O/c21-17-8-5-14(6-9-17)12-23-19-10-7-16(13-24-19)20(26)25-18-4-2-1-3-15(18)11-22/h1-10,13H,12H2,(H,23,24)(H,25,26)
InChIKeySVQSHLATTSBNHE-UHFFFAOYSA-N
MW362.82 g/mol
LogP4.47
Rot. Bonds5

About 6-[(4-chlorophenyl)methylamino]-N-(2-cyanophenyl)pyridine-3-carboxamide

6-[(4-chlorophenyl)methylamino]-N-(2-cyanophenyl)pyridine-3-carboxamide (PubChem CID 109156965) has the molecular formula C20H15ClN4O and a molecular weight of 362.82 g/mol. Its IUPAC name is 6-[(4-chlorophenyl)methylamino]-N-(2-cyanophenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-[(4-chlorophenyl)methylamino]-N-(2-cyanophenyl)pyridine-3-carboxamide
PubChem CID109156965
Molecular FormulaC20H15ClN4O
Molecular Weight362.82 g/mol
Exact Mass362.09
IUPAC Name6-[(4-chlorophenyl)methylamino]-N-(2-cyanophenyl)pyridine-3-carboxamide
SMILESN#Cc1ccccc1NC(=O)c1ccc(NCc2ccc(Cl)cc2)nc1
InChIInChI=1S/C20H15ClN4O/c21-17-8-5-14(6-9-17)12-23-19-10-7-16(13-24-19)20(26)25-18-4-2-1-3-15(18)11-22/h1-10,13H,12H2,(H,23,24)(H,25,26)
InChIKeySVQSHLATTSBNHE-UHFFFAOYSA-N
XLogP4.47
TPSA77.81 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.82
LogP ≤ 54.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 6-[(4-chlorophenyl)methylamino]-N-(2-cyanophenyl)pyridine-3-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

6-(benzylamino)-N-(2,5-dichlorophenyl)pyridine-3-carboxamide
CID 109155556
N-(3-chlorophenyl)-6-[(4-chlorophenyl)methylamino]pyridine-3-carboxamide
CID 109156937
1-[(4-chlorophenyl)methyl]-3-(2-cyanophenyl)urea
CID 108899194
N-(4-acetamidophenyl)-6-[(4-chlorophenyl)methylamino]pyridine-3-carboxamide
CID 109156954
1-N-[(4-chlorophenyl)methyl]-3-N-(2-cyanophenyl)benzene-1,3-dicarboxamide
CID 109054791
6-[(4-chlorophenyl)methylamino]pyridine-3-carboxylic acid
CID 28740301
2-N-[(4-chlorophenyl)methyl]-4-N-(2-cyanophenyl)pyridine-2,4-dicarboxamide
CID 109086782
N-(2-cyanophenyl)-6-(3,4-difluoroanilino)pyridine-3-carboxamide
CID 109164997
6-[(4-chlorophenyl)methylamino]pyridine-3-carboxamide
CID 112722784
6-[(4-chlorophenyl)methylamino]-N-(1-phenylethyl)pyridine-3-carboxamide
CID 109156184
N-(4-chloro-2-methylphenyl)-6-[(4-fluorophenyl)methylamino]pyridine-3-carboxamide
CID 109156635
4-chloro-N-[5-[(4-chlorophenyl)methylamino]-2-pyridinyl]benzamide
CID 113027275

Frequently Asked Questions

What is the IUPAC name of 6-[(4-chlorophenyl)methylamino]-N-(2-cyanophenyl)pyridine-3-carboxamide?
The IUPAC name of 6-[(4-chlorophenyl)methylamino]-N-(2-cyanophenyl)pyridine-3-carboxamide (CID 109156965) is 6-[(4-chlorophenyl)methylamino]-N-(2-cyanophenyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-[(4-chlorophenyl)methylamino]-N-(2-cyanophenyl)pyridine-3-carboxamide?
The canonical SMILES for 6-[(4-chlorophenyl)methylamino]-N-(2-cyanophenyl)pyridine-3-carboxamide is N#Cc1ccccc1NC(=O)c1ccc(NCc2ccc(Cl)cc2)nc1.
What is the InChIKey of 6-[(4-chlorophenyl)methylamino]-N-(2-cyanophenyl)pyridine-3-carboxamide?
The InChIKey is SVQSHLATTSBNHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15ClN4O/c21-17-8-5-14(6-9-17)12-23-19-10-7-16(13-24-19)20(26)25-18-4-2-1-3-15(18)11-22/h1-10,13H,12H2,(H,23,24)(H,25,26).
What are the key properties of 6-[(4-chlorophenyl)methylamino]-N-(2-cyanophenyl)pyridine-3-carboxamide?
6-[(4-chlorophenyl)methylamino]-N-(2-cyanophenyl)pyridine-3-carboxamide has a molecular weight of 362.82 g/mol, XLogP of 4.47, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(4-chlorophenyl)methylamino]-N-(2-cyanophenyl)pyridine-3-carboxamide is sourced from PubChem (CID 109156965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).