4-chloro-2-[[2-(2-chloro-4-fluoroanilino)-2-oxoethyl]amino]benzamide

C15H12Cl2FN3O2 — CID 33013992

IUPAC4-chloro-2-[[2-(2-chloro-4-fluoroanilino)-2-oxoethyl]amino]benzamide
SMILESNC(=O)c1ccc(Cl)cc1NCC(=O)Nc1ccc(F)cc1Cl
InChIInChI=1S/C15H12Cl2FN3O2/c16-8-1-3-10(15(19)23)13(5-8)20-7-14(22)21-12-4-2-9(18)6-11(12)17/h1-6,20H,7H2,(H2,19,23)(H,21,22)
InChIKeyPQPZCHBHCNVVIL-UHFFFAOYSA-N
MW356.18 g/mol
LogP3.28
Rot. Bonds5

About 4-chloro-2-[[2-(2-chloro-4-fluoroanilino)-2-oxoethyl]amino]benzamide

4-chloro-2-[[2-(2-chloro-4-fluoroanilino)-2-oxoethyl]amino]benzamide (PubChem CID 33013992) has the molecular formula C15H12Cl2FN3O2 and a molecular weight of 356.18 g/mol. Its IUPAC name is 4-chloro-2-[[2-(2-chloro-4-fluoroanilino)-2-oxoethyl]amino]benzamide.

Molecular Properties

Compound Name4-chloro-2-[[2-(2-chloro-4-fluoroanilino)-2-oxoethyl]amino]benzamide
PubChem CID33013992
Molecular FormulaC15H12Cl2FN3O2
Molecular Weight356.18 g/mol
Exact Mass355.03
IUPAC Name4-chloro-2-[[2-(2-chloro-4-fluoroanilino)-2-oxoethyl]amino]benzamide
SMILESNC(=O)c1ccc(Cl)cc1NCC(=O)Nc1ccc(F)cc1Cl
InChIInChI=1S/C15H12Cl2FN3O2/c16-8-1-3-10(15(19)23)13(5-8)20-7-14(22)21-12-4-2-9(18)6-11(12)17/h1-6,20H,7H2,(H2,19,23)(H,21,22)
InChIKeyPQPZCHBHCNVVIL-UHFFFAOYSA-N
XLogP3.28
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.18
LogP ≤ 53.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 4-chloro-2-[[2-(2-chloro-4-fluoroanilino)-2-oxoethyl]amino]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-(2-chloro-4-fluorophenyl)-2-(5-chloro-2-methoxyanilino)acetamide
CID 9099062
2-(2,4-dichloroanilino)-N-(2,4-dichlorophenyl)acetamide
CID 54811499
N-(2-chloro-4-fluorophenyl)-2-(2,5-dimethylanilino)acetamide
CID 9079599
2-(5-chloro-2-methylanilino)-N-(2,5-difluorophenyl)acetamide
CID 37479978
N-(2-chloro-4-fluorophenyl)-2-(2,6-dimethylanilino)acetamide
CID 51253129
2-(2-chloro-4-fluoroanilino)-N-(2,6-dichlorophenyl)acetamide
CID 43404197
2-(3-chloro-4-fluoroanilino)-N-(2,4-dichlorophenyl)acetamide
CID 26437681
N-(2,4-dichlorophenyl)-2-(2,6-difluoroanilino)acetamide
CID 78822630
2-(2,4-difluoroanilino)-N-(2,4-difluorophenyl)acetamide
CID 109011050
2-(4-acetylanilino)-N-(2-chloro-4-fluorophenyl)acetamide
CID 26416052
[2-(2-chloro-4-fluoroanilino)-2-oxoethyl] 5-chloro-2-hydroxybenzoate
CID 8604243
N-[2-(2,4-dichloroanilino)-2-oxoethyl]-2-(4-fluorophenyl)acetamide
CID 113001259

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-[[2-(2-chloro-4-fluoroanilino)-2-oxoethyl]amino]benzamide?
The IUPAC name of 4-chloro-2-[[2-(2-chloro-4-fluoroanilino)-2-oxoethyl]amino]benzamide (CID 33013992) is 4-chloro-2-[[2-(2-chloro-4-fluoroanilino)-2-oxoethyl]amino]benzamide.
What is the SMILES notation for 4-chloro-2-[[2-(2-chloro-4-fluoroanilino)-2-oxoethyl]amino]benzamide?
The canonical SMILES for 4-chloro-2-[[2-(2-chloro-4-fluoroanilino)-2-oxoethyl]amino]benzamide is NC(=O)c1ccc(Cl)cc1NCC(=O)Nc1ccc(F)cc1Cl.
What is the InChIKey of 4-chloro-2-[[2-(2-chloro-4-fluoroanilino)-2-oxoethyl]amino]benzamide?
The InChIKey is PQPZCHBHCNVVIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12Cl2FN3O2/c16-8-1-3-10(15(19)23)13(5-8)20-7-14(22)21-12-4-2-9(18)6-11(12)17/h1-6,20H,7H2,(H2,19,23)(H,21,22).
What are the key properties of 4-chloro-2-[[2-(2-chloro-4-fluoroanilino)-2-oxoethyl]amino]benzamide?
4-chloro-2-[[2-(2-chloro-4-fluoroanilino)-2-oxoethyl]amino]benzamide has a molecular weight of 356.18 g/mol, XLogP of 3.28, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-[[2-(2-chloro-4-fluoroanilino)-2-oxoethyl]amino]benzamide is sourced from PubChem (CID 33013992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).