N-(2-bromophenyl)-3-chloro-5-methylbenzamide

C14H11BrClNO — CID 80948909

IUPACN-(2-bromophenyl)-3-chloro-5-methylbenzamide
SMILESCc1cc(Cl)cc(C(=O)Nc2ccccc2Br)c1
InChIInChI=1S/C14H11BrClNO/c1-9-6-10(8-11(16)7-9)14(18)17-13-5-3-2-4-12(13)15/h2-8H,1H3,(H,17,18)
InChIKeyFXRBYHZJMHSQHL-UHFFFAOYSA-N
MW324.61 g/mol
LogP4.66
Rot. Bonds2

About N-(2-bromophenyl)-3-chloro-5-methylbenzamide

N-(2-bromophenyl)-3-chloro-5-methylbenzamide (PubChem CID 80948909) has the molecular formula C14H11BrClNO and a molecular weight of 324.61 g/mol. Its IUPAC name is N-(2-bromophenyl)-3-chloro-5-methylbenzamide.

Molecular Properties

Compound NameN-(2-bromophenyl)-3-chloro-5-methylbenzamide
PubChem CID80948909
Molecular FormulaC14H11BrClNO
Molecular Weight324.61 g/mol
Exact Mass322.97
IUPAC NameN-(2-bromophenyl)-3-chloro-5-methylbenzamide
SMILESCc1cc(Cl)cc(C(=O)Nc2ccccc2Br)c1
InChIInChI=1S/C14H11BrClNO/c1-9-6-10(8-11(16)7-9)14(18)17-13-5-3-2-4-12(13)15/h2-8H,1H3,(H,17,18)
InChIKeyFXRBYHZJMHSQHL-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-(2-bromo-3-chlorophenyl)-3-chloro-5-methylbenzamide
CID 103479767
N-(2-bromo-5-fluorophenyl)-3-chloro-5-methylbenzamide
CID 103774481
N-(3-bromo-2-methylphenyl)-3,5-dichlorobenzamide
CID 107640531
N-(2-bromo-4-methylphenyl)-3,5-dichlorobenzamide
CID 4271620
3-chloro-N-(2-chloro-3-pyridinyl)-5-methylbenzamide
CID 103773111
3,5-dibromo-N-(2-bromophenyl)benzamide
CID 107972328
N-(2-bromo-4-chlorophenyl)-3-fluoro-5-methylbenzamide
CID 112699952
N-(2-bromo-5-chlorophenyl)-3-fluoro-5-methylbenzamide
CID 112701714
3-[(3-chloro-5-methylbenzoyl)amino]pyridine-2-carboxylic acid
CID 104740205
N-[2-(3-aminoprop-1-ynyl)phenyl]-3-chloro-5-methylbenzamide
CID 81315690
N-(4-bromo-2-pyridinyl)-3-chloro-5-methylbenzamide
CID 102674199
N-(4-amino-2-fluorophenyl)-3-chloro-5-methylbenzamide
CID 81326271

Frequently Asked Questions

What is the IUPAC name of N-(2-bromophenyl)-3-chloro-5-methylbenzamide?
The IUPAC name of N-(2-bromophenyl)-3-chloro-5-methylbenzamide (CID 80948909) is N-(2-bromophenyl)-3-chloro-5-methylbenzamide.
What is the SMILES notation for N-(2-bromophenyl)-3-chloro-5-methylbenzamide?
The canonical SMILES for N-(2-bromophenyl)-3-chloro-5-methylbenzamide is Cc1cc(Cl)cc(C(=O)Nc2ccccc2Br)c1.
What is the InChIKey of N-(2-bromophenyl)-3-chloro-5-methylbenzamide?
The InChIKey is FXRBYHZJMHSQHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11BrClNO/c1-9-6-10(8-11(16)7-9)14(18)17-13-5-3-2-4-12(13)15/h2-8H,1H3,(H,17,18).
What are the key properties of N-(2-bromophenyl)-3-chloro-5-methylbenzamide?
N-(2-bromophenyl)-3-chloro-5-methylbenzamide 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 N-(2-bromophenyl)-3-chloro-5-methylbenzamide is sourced from PubChem (CID 80948909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).