3-chloro-N-[3-[(3-chlorobenzoyl)amino]phenyl]benzamide

C20H14Cl2N2O2 — CID 1369981

IUPAC3-chloro-N-[3-[(3-chlorobenzoyl)amino]phenyl]benzamide
SMILESO=C(Nc1cccc(NC(=O)c2cccc(Cl)c2)c1)c1cccc(Cl)c1
InChIInChI=1S/C20H14Cl2N2O2/c21-15-6-1-4-13(10-15)19(25)23-17-8-3-9-18(12-17)24-20(26)14-5-2-7-16(22)11-14/h1-12H,(H,23,25)(H,24,26)
InChIKeyJKHBACOFQDYETG-UHFFFAOYSA-N
MW385.25 g/mol
LogP5.50
Rot. Bonds4

About 3-chloro-N-[3-[(3-chlorobenzoyl)amino]phenyl]benzamide

3-chloro-N-[3-[(3-chlorobenzoyl)amino]phenyl]benzamide (PubChem CID 1369981) has the molecular formula C20H14Cl2N2O2 and a molecular weight of 385.25 g/mol. Its IUPAC name is 3-chloro-N-[3-[(3-chlorobenzoyl)amino]phenyl]benzamide.

Molecular Properties

Compound Name3-chloro-N-[3-[(3-chlorobenzoyl)amino]phenyl]benzamide
PubChem CID1369981
Molecular FormulaC20H14Cl2N2O2
Molecular Weight385.25 g/mol
Exact Mass384.04
IUPAC Name3-chloro-N-[3-[(3-chlorobenzoyl)amino]phenyl]benzamide
SMILESO=C(Nc1cccc(NC(=O)c2cccc(Cl)c2)c1)c1cccc(Cl)c1
InChIInChI=1S/C20H14Cl2N2O2/c21-15-6-1-4-13(10-15)19(25)23-17-8-3-9-18(12-17)24-20(26)14-5-2-7-16(22)11-14/h1-12H,(H,23,25)(H,24,26)
InChIKeyJKHBACOFQDYETG-UHFFFAOYSA-N
XLogP5.50
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500385.25
LogP ≤ 55.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-acetamidophenyl)-3-chlorobenzamide
CID 669190
3-chloro-N-(3-methylphenyl)benzamide
CID 722373
3-[[3-[(3-chlorobenzoyl)amino]benzoyl]amino]benzoate
CID 3383614
N-[3-[(3-chlorobenzoyl)amino]phenyl]naphthalene-2-carboxamide
CID 1366118
3-chloro-N-[3-(2,2-dimethylpropanoylamino)phenyl]benzamide
CID 17102477
3-chloro-N-[3-(sulfamoylamino)phenyl]benzamide
CID 60729874
3-chloro-N-pyridin-4-ylbenzamide
CID 849128
3-N-(3-chlorophenyl)benzene-1,3-dicarboxamide
CID 35554073
3-chloro-N-[3-[(2-methoxyacetyl)amino]phenyl]benzamide
CID 46879470
3-chloro-N-[3-[(1S)-1-hydroxyethyl]phenyl]benzamide
CID 27209859
3-chloro-N-(3-sulfamoylphenyl)benzamide
CID 26580558
3-chloro-N-(4-methylphenyl)benzamide
CID 722375

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-[3-[(3-chlorobenzoyl)amino]phenyl]benzamide?
The IUPAC name of 3-chloro-N-[3-[(3-chlorobenzoyl)amino]phenyl]benzamide (CID 1369981) is 3-chloro-N-[3-[(3-chlorobenzoyl)amino]phenyl]benzamide.
What is the SMILES notation for 3-chloro-N-[3-[(3-chlorobenzoyl)amino]phenyl]benzamide?
The canonical SMILES for 3-chloro-N-[3-[(3-chlorobenzoyl)amino]phenyl]benzamide is O=C(Nc1cccc(NC(=O)c2cccc(Cl)c2)c1)c1cccc(Cl)c1.
What is the InChIKey of 3-chloro-N-[3-[(3-chlorobenzoyl)amino]phenyl]benzamide?
The InChIKey is JKHBACOFQDYETG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14Cl2N2O2/c21-15-6-1-4-13(10-15)19(25)23-17-8-3-9-18(12-17)24-20(26)14-5-2-7-16(22)11-14/h1-12H,(H,23,25)(H,24,26).
What are the key properties of 3-chloro-N-[3-[(3-chlorobenzoyl)amino]phenyl]benzamide?
3-chloro-N-[3-[(3-chlorobenzoyl)amino]phenyl]benzamide has a molecular weight of 385.25 g/mol, XLogP of 5.50, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-[3-[(3-chlorobenzoyl)amino]phenyl]benzamide is sourced from PubChem (CID 1369981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).