2-bromo-4-chloro-N-(4-methylphenyl)benzamide

C14H11BrClNO — CID 103763138

IUPAC2-bromo-4-chloro-N-(4-methylphenyl)benzamide
SMILESCc1ccc(NC(=O)c2ccc(Cl)cc2Br)cc1
InChIInChI=1S/C14H11BrClNO/c1-9-2-5-11(6-3-9)17-14(18)12-7-4-10(16)8-13(12)15/h2-8H,1H3,(H,17,18)
InChIKeyXJGZDZKKYLSFDR-UHFFFAOYSA-N
MW324.61 g/mol
LogP4.66
Rot. Bonds2

About 2-bromo-4-chloro-N-(4-methylphenyl)benzamide

2-bromo-4-chloro-N-(4-methylphenyl)benzamide (PubChem CID 103763138) has the molecular formula C14H11BrClNO and a molecular weight of 324.61 g/mol. Its IUPAC name is 2-bromo-4-chloro-N-(4-methylphenyl)benzamide.

Molecular Properties

Compound Name2-bromo-4-chloro-N-(4-methylphenyl)benzamide
PubChem CID103763138
Molecular FormulaC14H11BrClNO
Molecular Weight324.61 g/mol
Exact Mass322.97
IUPAC Name2-bromo-4-chloro-N-(4-methylphenyl)benzamide
SMILESCc1ccc(NC(=O)c2ccc(Cl)cc2Br)cc1
InChIInChI=1S/C14H11BrClNO/c1-9-2-5-11(6-3-9)17-14(18)12-7-4-10(16)8-13(12)15/h2-8H,1H3,(H,17,18)
InChIKeyXJGZDZKKYLSFDR-UHFFFAOYSA-N
XLogP4.66
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.61
LogP ≤ 54.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(4-acetylphenyl)-2-bromo-4-chlorobenzamide
CID 103763178
2-bromo-4-chloro-N-(4-formylphenyl)benzamide
CID 107987879
2-bromo-N-(4-carbamoylphenyl)-4-chlorobenzamide
CID 103763181
2-bromo-4-chloro-N-[4-(chloromethyl)phenyl]benzamide
CID 107993837
2-amino-5-chloro-N-(4-methylphenyl)benzamide
CID 6481532
5-[(2-bromo-4-chlorobenzoyl)amino]-2-chlorobenzamide
CID 103763706
2-bromo-4-chloro-N-(3-chloro-4-methoxyphenyl)benzamide
CID 103763233
N-(3-bromo-4-fluorophenyl)-4-chloro-2-methylbenzamide
CID 114027991
2-chloro-N-(4-chlorophenyl)-5-methylbenzamide
CID 122630204
N-(6-amino-3-pyridinyl)-2-bromo-4-chlorobenzamide
CID 103806405
2-bromo-4-chloro-N-(2-methoxy-4-pyridinyl)benzamide
CID 112739552
2-bromo-N-(3,5-dichlorophenyl)-5-methylbenzamide
CID 81110211

Frequently Asked Questions

What is the IUPAC name of 2-bromo-4-chloro-N-(4-methylphenyl)benzamide?
The IUPAC name of 2-bromo-4-chloro-N-(4-methylphenyl)benzamide (CID 103763138) is 2-bromo-4-chloro-N-(4-methylphenyl)benzamide.
What is the SMILES notation for 2-bromo-4-chloro-N-(4-methylphenyl)benzamide?
The canonical SMILES for 2-bromo-4-chloro-N-(4-methylphenyl)benzamide is Cc1ccc(NC(=O)c2ccc(Cl)cc2Br)cc1.
What is the InChIKey of 2-bromo-4-chloro-N-(4-methylphenyl)benzamide?
The InChIKey is XJGZDZKKYLSFDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11BrClNO/c1-9-2-5-11(6-3-9)17-14(18)12-7-4-10(16)8-13(12)15/h2-8H,1H3,(H,17,18).
What are the key properties of 2-bromo-4-chloro-N-(4-methylphenyl)benzamide?
2-bromo-4-chloro-N-(4-methylphenyl)benzamide has a molecular weight of 324.61 g/mol, XLogP of 4.66, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-4-chloro-N-(4-methylphenyl)benzamide is sourced from PubChem (CID 103763138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).