N-(2-chloro-4-cyanophenyl)-3-(2,4-difluorophenyl)benzamide

C20H11ClF2N2O — CID 174160226

IUPACN-(2-chloro-4-cyanophenyl)-3-(2,4-difluorophenyl)benzamide
SMILESN#Cc1ccc(NC(=O)c2cccc(-c3ccc(F)cc3F)c2)c(Cl)c1
InChIInChI=1S/C20H11ClF2N2O/c21-17-8-12(11-24)4-7-19(17)25-20(26)14-3-1-2-13(9-14)16-6-5-15(22)10-18(16)23/h1-10H,(H,25,26)
InChIKeyDJXYAQQMAPPQEX-UHFFFAOYSA-N
MW368.77 g/mol
LogP5.41
Rot. Bonds3

About N-(2-chloro-4-cyanophenyl)-3-(2,4-difluorophenyl)benzamide

N-(2-chloro-4-cyanophenyl)-3-(2,4-difluorophenyl)benzamide (PubChem CID 174160226) has the molecular formula C20H11ClF2N2O and a molecular weight of 368.77 g/mol. Its IUPAC name is N-(2-chloro-4-cyanophenyl)-3-(2,4-difluorophenyl)benzamide.

Molecular Properties

Compound NameN-(2-chloro-4-cyanophenyl)-3-(2,4-difluorophenyl)benzamide
PubChem CID174160226
Molecular FormulaC20H11ClF2N2O
Molecular Weight368.77 g/mol
Exact Mass368.05
IUPAC NameN-(2-chloro-4-cyanophenyl)-3-(2,4-difluorophenyl)benzamide
SMILESN#Cc1ccc(NC(=O)c2cccc(-c3ccc(F)cc3F)c2)c(Cl)c1
InChIInChI=1S/C20H11ClF2N2O/c21-17-8-12(11-24)4-7-19(17)25-20(26)14-3-1-2-13(9-14)16-6-5-15(22)10-18(16)23/h1-10H,(H,25,26)
InChIKeyDJXYAQQMAPPQEX-UHFFFAOYSA-N
XLogP5.41
TPSA52.89 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500368.77
LogP ≤ 55.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(2-chloro-4-cyanophenyl)-3-(2,4-difluorophenyl)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

4-chloro-N-(2-chloro-4-cyanophenyl)benzamide
CID 103799745
2-chloro-N-(2-chloro-4-cyanophenyl)-6-fluorobenzamide
CID 103811173
1-N-(3-cyanophenyl)-3-N-(2,4-difluorophenyl)benzene-1,3-dicarboxamide
CID 109057785
N-(2-chloro-4-cyanophenyl)-5-(2-fluoro-4-methylphenyl)-2-hydroxybenzamide
CID 167080575
N-(2-chloro-4-cyanophenyl)-2-fluoropyridine-4-carboxamide
CID 103799816
N-(2-chloro-4-methylphenyl)-3-cyanobenzamide
CID 7760531
N-(2-chloro-4-cyanophenyl)-2,6-dihydroxybenzamide
CID 107808194
2,5-dichloro-N-(2-chloro-4-cyanophenyl)benzamide
CID 103799731
N-(2-chloro-4-fluorophenyl)-3-iodobenzamide
CID 26364200
N-(2-chloro-4-cyanophenyl)-2-fluoro-3-methylbenzamide
CID 103811028
1-N-(2-cyanophenyl)-3-N-(2,4-difluorophenyl)benzene-1,3-dicarboxamide
CID 109057784
N-(2-chloro-4-fluorophenyl)-5-cyanopyridine-2-carboxamide
CID 63719479

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-4-cyanophenyl)-3-(2,4-difluorophenyl)benzamide?
The IUPAC name of N-(2-chloro-4-cyanophenyl)-3-(2,4-difluorophenyl)benzamide (CID 174160226) is N-(2-chloro-4-cyanophenyl)-3-(2,4-difluorophenyl)benzamide.
What is the SMILES notation for N-(2-chloro-4-cyanophenyl)-3-(2,4-difluorophenyl)benzamide?
The canonical SMILES for N-(2-chloro-4-cyanophenyl)-3-(2,4-difluorophenyl)benzamide is N#Cc1ccc(NC(=O)c2cccc(-c3ccc(F)cc3F)c2)c(Cl)c1.
What is the InChIKey of N-(2-chloro-4-cyanophenyl)-3-(2,4-difluorophenyl)benzamide?
The InChIKey is DJXYAQQMAPPQEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H11ClF2N2O/c21-17-8-12(11-24)4-7-19(17)25-20(26)14-3-1-2-13(9-14)16-6-5-15(22)10-18(16)23/h1-10H,(H,25,26).
What are the key properties of N-(2-chloro-4-cyanophenyl)-3-(2,4-difluorophenyl)benzamide?
N-(2-chloro-4-cyanophenyl)-3-(2,4-difluorophenyl)benzamide has a molecular weight of 368.77 g/mol, XLogP of 5.41, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-4-cyanophenyl)-3-(2,4-difluorophenyl)benzamide is sourced from PubChem (CID 174160226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).