4-chloro-N-(2-chloro-4-cyanophenyl)benzamide

C14H8Cl2N2O — CID 103799745

IUPAC4-chloro-N-(2-chloro-4-cyanophenyl)benzamide
SMILESN#Cc1ccc(NC(=O)c2ccc(Cl)cc2)c(Cl)c1
InChIInChI=1S/C14H8Cl2N2O/c15-11-4-2-10(3-5-11)14(19)18-13-6-1-9(8-17)7-12(13)16/h1-7H,(H,18,19)
InChIKeyCPEXIPSLOUJRKL-UHFFFAOYSA-N
MW291.14 g/mol
LogP4.12
Rot. Bonds2

About 4-chloro-N-(2-chloro-4-cyanophenyl)benzamide

4-chloro-N-(2-chloro-4-cyanophenyl)benzamide (PubChem CID 103799745) has the molecular formula C14H8Cl2N2O and a molecular weight of 291.14 g/mol. Its IUPAC name is 4-chloro-N-(2-chloro-4-cyanophenyl)benzamide.

Molecular Properties

Compound Name4-chloro-N-(2-chloro-4-cyanophenyl)benzamide
PubChem CID103799745
Molecular FormulaC14H8Cl2N2O
Molecular Weight291.14 g/mol
Exact Mass290.00
IUPAC Name4-chloro-N-(2-chloro-4-cyanophenyl)benzamide
SMILESN#Cc1ccc(NC(=O)c2ccc(Cl)cc2)c(Cl)c1
InChIInChI=1S/C14H8Cl2N2O/c15-11-4-2-10(3-5-11)14(19)18-13-6-1-9(8-17)7-12(13)16/h1-7H,(H,18,19)
InChIKeyCPEXIPSLOUJRKL-UHFFFAOYSA-N
XLogP4.12
TPSA52.89 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.14
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,5-dichloro-N-(2-chloro-4-cyanophenyl)benzamide
CID 103799731
5-chloro-N-(2-chloro-4-cyanophenyl)pyridine-2-carboxamide
CID 103811024
1-(2-chloro-4-cyanophenyl)-3-(4-chlorophenyl)urea
CID 107808212
6-amino-N-(2-chloro-4-cyanophenyl)pyridine-3-carboxamide
CID 107810194
N-(2-chloro-4-cyanophenyl)-6-methylpyridine-3-carboxamide
CID 103799813
2-amino-4-chloro-N-(2-chloro-4-cyanophenyl)benzamide
CID 107806873
N-(2-chloro-4-cyanophenyl)-5-hydroxypyridine-3-carboxamide
CID 107808799
4-N-(4-chlorophenyl)-1-N-(4-cyanophenyl)benzene-1,4-dicarboxamide
CID 109049994
N-(2-chloro-4-cyanophenyl)-2,6-dihydroxybenzamide
CID 107808194
N-(2-chloro-4-cyanophenyl)-2-fluoropyridine-4-carboxamide
CID 103799816
2-amino-N-(2-chloro-4-cyanophenyl)pyridine-4-carboxamide
CID 107810212
2-chloro-N-(2-chloro-4-cyanophenyl)-6-fluorobenzamide
CID 103811173

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(2-chloro-4-cyanophenyl)benzamide?
The IUPAC name of 4-chloro-N-(2-chloro-4-cyanophenyl)benzamide (CID 103799745) is 4-chloro-N-(2-chloro-4-cyanophenyl)benzamide.
What is the SMILES notation for 4-chloro-N-(2-chloro-4-cyanophenyl)benzamide?
The canonical SMILES for 4-chloro-N-(2-chloro-4-cyanophenyl)benzamide is N#Cc1ccc(NC(=O)c2ccc(Cl)cc2)c(Cl)c1.
What is the InChIKey of 4-chloro-N-(2-chloro-4-cyanophenyl)benzamide?
The InChIKey is CPEXIPSLOUJRKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8Cl2N2O/c15-11-4-2-10(3-5-11)14(19)18-13-6-1-9(8-17)7-12(13)16/h1-7H,(H,18,19).
What are the key properties of 4-chloro-N-(2-chloro-4-cyanophenyl)benzamide?
4-chloro-N-(2-chloro-4-cyanophenyl)benzamide has a molecular weight of 291.14 g/mol, XLogP of 4.12, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(2-chloro-4-cyanophenyl)benzamide is sourced from PubChem (CID 103799745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).