2-bromo-4-chloro-N-(4-chloro-3-cyanophenyl)benzamide

C14H7BrCl2N2O — CID 103763591

IUPAC2-bromo-4-chloro-N-(4-chloro-3-cyanophenyl)benzamide
SMILESN#Cc1cc(NC(=O)c2ccc(Cl)cc2Br)ccc1Cl
InChIInChI=1S/C14H7BrCl2N2O/c15-12-6-9(16)1-3-11(12)14(20)19-10-2-4-13(17)8(5-10)7-18/h1-6H,(H,19,20)
InChIKeyGAEBUKSVZXGPRZ-UHFFFAOYSA-N
MW370.03 g/mol
LogP4.88
Rot. Bonds2

About 2-bromo-4-chloro-N-(4-chloro-3-cyanophenyl)benzamide

2-bromo-4-chloro-N-(4-chloro-3-cyanophenyl)benzamide (PubChem CID 103763591) has the molecular formula C14H7BrCl2N2O and a molecular weight of 370.03 g/mol. Its IUPAC name is 2-bromo-4-chloro-N-(4-chloro-3-cyanophenyl)benzamide.

Molecular Properties

Compound Name2-bromo-4-chloro-N-(4-chloro-3-cyanophenyl)benzamide
PubChem CID103763591
Molecular FormulaC14H7BrCl2N2O
Molecular Weight370.03 g/mol
Exact Mass367.91
IUPAC Name2-bromo-4-chloro-N-(4-chloro-3-cyanophenyl)benzamide
SMILESN#Cc1cc(NC(=O)c2ccc(Cl)cc2Br)ccc1Cl
InChIInChI=1S/C14H7BrCl2N2O/c15-12-6-9(16)1-3-11(12)14(20)19-10-2-4-13(17)8(5-10)7-18/h1-6H,(H,19,20)
InChIKeyGAEBUKSVZXGPRZ-UHFFFAOYSA-N
XLogP4.88
TPSA52.89 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.03
LogP ≤ 54.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-[(2-bromo-4-chlorobenzoyl)amino]-2-chlorobenzamide
CID 103763706
4-bromo-3-chloro-N-(4-chloro-3-cyanophenyl)benzamide
CID 81308168
2-bromo-4-chloro-N-(4-chloro-3-nitrophenyl)benzamide
CID 103763477
N-(4-chloro-3-cyanophenyl)-2-fluoro-5-methylbenzamide
CID 62510457
2-amino-5-chloro-N-(3,4-dicyanophenyl)benzamide
CID 107786836
2-bromo-N-(4-carbamoylphenyl)-4-chlorobenzamide
CID 103763181
N-(4-acetylphenyl)-2-bromo-4-chlorobenzamide
CID 103763178
4-chloro-N-(3-cyano-4-fluorophenyl)-2-hydroxybenzamide
CID 62316486
2-bromo-4-chloro-N-(4-methylphenyl)benzamide
CID 103763138
N-(4-amino-2-cyanophenyl)-2-bromo-4-chlorobenzamide
CID 107986297
2-amino-4-chloro-N-(3-chloro-4-cyanophenyl)benzamide
CID 43168358
2-bromo-4-chloro-N-(3-chloro-4-methoxyphenyl)benzamide
CID 103763233

Frequently Asked Questions

What is the IUPAC name of 2-bromo-4-chloro-N-(4-chloro-3-cyanophenyl)benzamide?
The IUPAC name of 2-bromo-4-chloro-N-(4-chloro-3-cyanophenyl)benzamide (CID 103763591) is 2-bromo-4-chloro-N-(4-chloro-3-cyanophenyl)benzamide.
What is the SMILES notation for 2-bromo-4-chloro-N-(4-chloro-3-cyanophenyl)benzamide?
The canonical SMILES for 2-bromo-4-chloro-N-(4-chloro-3-cyanophenyl)benzamide is N#Cc1cc(NC(=O)c2ccc(Cl)cc2Br)ccc1Cl.
What is the InChIKey of 2-bromo-4-chloro-N-(4-chloro-3-cyanophenyl)benzamide?
The InChIKey is GAEBUKSVZXGPRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H7BrCl2N2O/c15-12-6-9(16)1-3-11(12)14(20)19-10-2-4-13(17)8(5-10)7-18/h1-6H,(H,19,20).
What are the key properties of 2-bromo-4-chloro-N-(4-chloro-3-cyanophenyl)benzamide?
2-bromo-4-chloro-N-(4-chloro-3-cyanophenyl)benzamide has a molecular weight of 370.03 g/mol, XLogP of 4.88, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-4-chloro-N-(4-chloro-3-cyanophenyl)benzamide is sourced from PubChem (CID 103763591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).