2,6-dichloro-N-(5-chloro-2-cyanophenyl)benzamide

C14H7Cl3N2O — CID 60628736

IUPAC2,6-dichloro-N-(5-chloro-2-cyanophenyl)benzamide
SMILESN#Cc1ccc(Cl)cc1NC(=O)c1c(Cl)cccc1Cl
InChIInChI=1S/C14H7Cl3N2O/c15-9-5-4-8(7-18)12(6-9)19-14(20)13-10(16)2-1-3-11(13)17/h1-6H,(H,19,20)
InChIKeyUSQXJCDSOQEQFG-UHFFFAOYSA-N
MW325.58 g/mol
LogP4.77
Rot. Bonds2

About 2,6-dichloro-N-(5-chloro-2-cyanophenyl)benzamide

2,6-dichloro-N-(5-chloro-2-cyanophenyl)benzamide (PubChem CID 60628736) has the molecular formula C14H7Cl3N2O and a molecular weight of 325.58 g/mol. Its IUPAC name is 2,6-dichloro-N-(5-chloro-2-cyanophenyl)benzamide.

Molecular Properties

Compound Name2,6-dichloro-N-(5-chloro-2-cyanophenyl)benzamide
PubChem CID60628736
Molecular FormulaC14H7Cl3N2O
Molecular Weight325.58 g/mol
Exact Mass323.96
IUPAC Name2,6-dichloro-N-(5-chloro-2-cyanophenyl)benzamide
SMILESN#Cc1ccc(Cl)cc1NC(=O)c1c(Cl)cccc1Cl
InChIInChI=1S/C14H7Cl3N2O/c15-9-5-4-8(7-18)12(6-9)19-14(20)13-10(16)2-1-3-11(13)17/h1-6H,(H,19,20)
InChIKeyUSQXJCDSOQEQFG-UHFFFAOYSA-N
XLogP4.77
TPSA52.89 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.58
LogP ≤ 54.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(5-chloro-2-cyanophenyl)-2,4,6-trifluorobenzamide
CID 65098727
2,6-dichloro-N-(2,4-dichlorophenyl)benzamide
CID 3637585
2-chloro-N-(5-chloro-2-cyanophenyl)-5-hydroxybenzamide
CID 106501019
N-(5-chloro-2-cyanophenyl)-4-fluorobenzamide
CID 60628744
N-(5-chloro-2-cyanophenyl)-4-methylbenzamide
CID 60628684
N-(5-chloro-2-cyanophenyl)-2-(2-chlorophenyl)acetamide
CID 60628654
5,6-dichloro-N-(5-chloro-2-cyanophenyl)pyridine-3-carboxamide
CID 60628665
2-chloro-N-(5-chloro-2-cyanophenyl)-4-methylbenzamide
CID 106861258
2-amino-N-(5-chloro-2-cyanophenyl)-3-methylbenzamide
CID 64914385
3-bromo-5-chloro-N-(5-chloro-2-cyanophenyl)benzamide
CID 107938866
2-chloro-N-(2-cyano-4-fluorophenyl)-6-fluorobenzamide
CID 82016640
3-chloro-N-(5-chloro-2-cyanophenyl)pyridine-4-carboxamide
CID 66463010

Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-N-(5-chloro-2-cyanophenyl)benzamide?
The IUPAC name of 2,6-dichloro-N-(5-chloro-2-cyanophenyl)benzamide (CID 60628736) is 2,6-dichloro-N-(5-chloro-2-cyanophenyl)benzamide.
What is the SMILES notation for 2,6-dichloro-N-(5-chloro-2-cyanophenyl)benzamide?
The canonical SMILES for 2,6-dichloro-N-(5-chloro-2-cyanophenyl)benzamide is N#Cc1ccc(Cl)cc1NC(=O)c1c(Cl)cccc1Cl.
What is the InChIKey of 2,6-dichloro-N-(5-chloro-2-cyanophenyl)benzamide?
The InChIKey is USQXJCDSOQEQFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H7Cl3N2O/c15-9-5-4-8(7-18)12(6-9)19-14(20)13-10(16)2-1-3-11(13)17/h1-6H,(H,19,20).
What are the key properties of 2,6-dichloro-N-(5-chloro-2-cyanophenyl)benzamide?
2,6-dichloro-N-(5-chloro-2-cyanophenyl)benzamide has a molecular weight of 325.58 g/mol, XLogP of 4.77, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-N-(5-chloro-2-cyanophenyl)benzamide is sourced from PubChem (CID 60628736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).