2-chloro-N-[4-[(4-chlorobenzoyl)amino]-2-methylphenyl]benzamide

C21H16Cl2N2O2 — CID 3135769

IUPAC2-chloro-N-[4-[(4-chlorobenzoyl)amino]-2-methylphenyl]benzamide
SMILESCc1cc(NC(=O)c2ccc(Cl)cc2)ccc1NC(=O)c1ccccc1Cl
InChIInChI=1S/C21H16Cl2N2O2/c1-13-12-16(24-20(26)14-6-8-15(22)9-7-14)10-11-19(13)25-21(27)17-4-2-3-5-18(17)23/h2-12H,1H3,(H,24,26)(H,25,27)
InChIKeyAMWZKJSGWDMAKC-UHFFFAOYSA-N
MW399.28 g/mol
LogP5.81
Rot. Bonds4

About 2-chloro-N-[4-[(4-chlorobenzoyl)amino]-2-methylphenyl]benzamide

2-chloro-N-[4-[(4-chlorobenzoyl)amino]-2-methylphenyl]benzamide (PubChem CID 3135769) has the molecular formula C21H16Cl2N2O2 and a molecular weight of 399.28 g/mol. Its IUPAC name is 2-chloro-N-[4-[(4-chlorobenzoyl)amino]-2-methylphenyl]benzamide.

Molecular Properties

Compound Name2-chloro-N-[4-[(4-chlorobenzoyl)amino]-2-methylphenyl]benzamide
PubChem CID3135769
Molecular FormulaC21H16Cl2N2O2
Molecular Weight399.28 g/mol
Exact Mass398.06
IUPAC Name2-chloro-N-[4-[(4-chlorobenzoyl)amino]-2-methylphenyl]benzamide
SMILESCc1cc(NC(=O)c2ccc(Cl)cc2)ccc1NC(=O)c1ccccc1Cl
InChIInChI=1S/C21H16Cl2N2O2/c1-13-12-16(24-20(26)14-6-8-15(22)9-7-14)10-11-19(13)25-21(27)17-4-2-3-5-18(17)23/h2-12H,1H3,(H,24,26)(H,25,27)
InChIKeyAMWZKJSGWDMAKC-UHFFFAOYSA-N
XLogP5.81
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500399.28
LogP ≤ 55.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-benzamido-3-methylphenyl)-4-chlorobenzamide
CID 1365594
4-chloro-N-[4-[(4-chlorobenzoyl)amino]-3-methylphenyl]benzamide
CID 27042156
2-chloro-N-[4-[(3,4-dimethylphenyl)carbamoyl]phenyl]benzamide
CID 2990559
2-chloro-N-(4-chlorophenyl)benzamide;4-chloro-N-(4-chlorophenyl)benzamide
CID 159735192
2-benzoyl-N-[4-[(4-chloro-2-methylphenyl)carbamoyl]phenyl]benzamide
CID 23935500
4-[(2-chlorobenzoyl)amino]-N,3-dimethylbenzamide
CID 131930892
N-(4-benzamido-3-methylphenyl)-2,4-dimethylbenzamide
CID 1288920
N-(4-benzamido-3-methylphenyl)-3,5-dichloro-2-methoxybenzamide
CID 22778979
2-chloro-N-[4-[4-[(2-chlorobenzoyl)amino]-3-methylphenyl]-2-methylphenyl]benzamide
CID 2313060
4-N-(4-chloro-2-methylphenyl)-1-N-(4-fluorophenyl)benzene-1,4-dicarboxamide
CID 109049900
N-(4-benzamido-3-methylphenyl)-2-chloro-4-nitrobenzamide
CID 23737728
N-(4-chloro-2-methylphenyl)-4-phenylbenzamide
CID 19174130

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[4-[(4-chlorobenzoyl)amino]-2-methylphenyl]benzamide?
The IUPAC name of 2-chloro-N-[4-[(4-chlorobenzoyl)amino]-2-methylphenyl]benzamide (CID 3135769) is 2-chloro-N-[4-[(4-chlorobenzoyl)amino]-2-methylphenyl]benzamide.
What is the SMILES notation for 2-chloro-N-[4-[(4-chlorobenzoyl)amino]-2-methylphenyl]benzamide?
The canonical SMILES for 2-chloro-N-[4-[(4-chlorobenzoyl)amino]-2-methylphenyl]benzamide is Cc1cc(NC(=O)c2ccc(Cl)cc2)ccc1NC(=O)c1ccccc1Cl.
What is the InChIKey of 2-chloro-N-[4-[(4-chlorobenzoyl)amino]-2-methylphenyl]benzamide?
The InChIKey is AMWZKJSGWDMAKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16Cl2N2O2/c1-13-12-16(24-20(26)14-6-8-15(22)9-7-14)10-11-19(13)25-21(27)17-4-2-3-5-18(17)23/h2-12H,1H3,(H,24,26)(H,25,27).
What are the key properties of 2-chloro-N-[4-[(4-chlorobenzoyl)amino]-2-methylphenyl]benzamide?
2-chloro-N-[4-[(4-chlorobenzoyl)amino]-2-methylphenyl]benzamide has a molecular weight of 399.28 g/mol, XLogP of 5.81, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[4-[(4-chlorobenzoyl)amino]-2-methylphenyl]benzamide is sourced from PubChem (CID 3135769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).