4-chloro-N-[6-(3-chloro-2-methylanilino)-3-pyridinyl]benzamide

C19H15Cl2N3O — CID 113018706

IUPAC4-chloro-N-[6-(3-chloro-2-methylanilino)-3-pyridinyl]benzamide
SMILESCc1c(Cl)cccc1Nc1ccc(NC(=O)c2ccc(Cl)cc2)cn1
InChIInChI=1S/C19H15Cl2N3O/c1-12-16(21)3-2-4-17(12)24-18-10-9-15(11-22-18)23-19(25)13-5-7-14(20)8-6-13/h2-11H,1H3,(H,22,24)(H,23,25)
InChIKeyJECJMOCRJPTBAA-UHFFFAOYSA-N
MW372.26 g/mol
LogP5.69
Rot. Bonds4

About 4-chloro-N-[6-(3-chloro-2-methylanilino)-3-pyridinyl]benzamide

4-chloro-N-[6-(3-chloro-2-methylanilino)-3-pyridinyl]benzamide (PubChem CID 113018706) has the molecular formula C19H15Cl2N3O and a molecular weight of 372.26 g/mol. Its IUPAC name is 4-chloro-N-[6-(3-chloro-2-methylanilino)-3-pyridinyl]benzamide.

Molecular Properties

Compound Name4-chloro-N-[6-(3-chloro-2-methylanilino)-3-pyridinyl]benzamide
PubChem CID113018706
Molecular FormulaC19H15Cl2N3O
Molecular Weight372.26 g/mol
Exact Mass371.06
IUPAC Name4-chloro-N-[6-(3-chloro-2-methylanilino)-3-pyridinyl]benzamide
SMILESCc1c(Cl)cccc1Nc1ccc(NC(=O)c2ccc(Cl)cc2)cn1
InChIInChI=1S/C19H15Cl2N3O/c1-12-16(21)3-2-4-17(12)24-18-10-9-15(11-22-18)23-19(25)13-5-7-14(20)8-6-13/h2-11H,1H3,(H,22,24)(H,23,25)
InChIKeyJECJMOCRJPTBAA-UHFFFAOYSA-N
XLogP5.69
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.26
LogP ≤ 55.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-chloro-N-[6-(3-chloro-2-methylanilino)-3-pyridinyl]benzamide 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-[6-(3-chloro-2-methylanilino)-3-pyridinyl]-4-fluorobenzamide
CID 113018688
4-chloro-N-[6-(2-chloroanilino)-3-pyridinyl]benzamide
CID 113018439
N-(4-acetylphenyl)-6-(3-chloro-2-methylanilino)pyridine-3-carboxamide
CID 109163537
4-chloro-N-[6-(2,4-dichloroanilino)-3-pyridinyl]benzamide
CID 113022233
4-chloro-N-[6-(2-propan-2-ylanilino)-3-pyridinyl]benzamide
CID 113017755
4-chloro-N-[6-(quinolin-8-ylamino)-3-pyridinyl]benzamide
CID 113021752
6-(3-chloro-2-methylanilino)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)pyridine-3-carboxamide
CID 109163546
6-(4-acetylanilino)-N-(3-chloro-2-methylphenyl)pyridine-3-carboxamide
CID 109163558
6-(3-chloro-2-methylanilino)-N-(3-cyanophenyl)pyridine-3-carboxamide
CID 109163549
N-[6-(2,3-dimethylanilino)-3-pyridinyl]-4-methoxybenzamide
CID 113017268
N-(4-chlorophenyl)-6-(2-methoxyanilino)pyridine-3-carboxamide
CID 109163500
N-(3-chloro-2-methylphenyl)-6-(methylamino)pyridine-3-carboxamide
CID 55042917

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-[6-(3-chloro-2-methylanilino)-3-pyridinyl]benzamide?
The IUPAC name of 4-chloro-N-[6-(3-chloro-2-methylanilino)-3-pyridinyl]benzamide (CID 113018706) is 4-chloro-N-[6-(3-chloro-2-methylanilino)-3-pyridinyl]benzamide.
What is the SMILES notation for 4-chloro-N-[6-(3-chloro-2-methylanilino)-3-pyridinyl]benzamide?
The canonical SMILES for 4-chloro-N-[6-(3-chloro-2-methylanilino)-3-pyridinyl]benzamide is Cc1c(Cl)cccc1Nc1ccc(NC(=O)c2ccc(Cl)cc2)cn1.
What is the InChIKey of 4-chloro-N-[6-(3-chloro-2-methylanilino)-3-pyridinyl]benzamide?
The InChIKey is JECJMOCRJPTBAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15Cl2N3O/c1-12-16(21)3-2-4-17(12)24-18-10-9-15(11-22-18)23-19(25)13-5-7-14(20)8-6-13/h2-11H,1H3,(H,22,24)(H,23,25).
What are the key properties of 4-chloro-N-[6-(3-chloro-2-methylanilino)-3-pyridinyl]benzamide?
4-chloro-N-[6-(3-chloro-2-methylanilino)-3-pyridinyl]benzamide has a molecular weight of 372.26 g/mol, XLogP of 5.69, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-[6-(3-chloro-2-methylanilino)-3-pyridinyl]benzamide is sourced from PubChem (CID 113018706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).