3-bromo-N-(3-bromo-5-methylphenyl)benzamide

C14H11Br2NO — CID 107583869

IUPAC3-bromo-N-(3-bromo-5-methylphenyl)benzamide
SMILESCc1cc(Br)cc(NC(=O)c2cccc(Br)c2)c1
InChIInChI=1S/C14H11Br2NO/c1-9-5-12(16)8-13(6-9)17-14(18)10-3-2-4-11(15)7-10/h2-8H,1H3,(H,17,18)
InChIKeyYJIUYFWZZCIUCR-UHFFFAOYSA-N
MW369.06 g/mol
LogP4.77
Rot. Bonds2

About 3-bromo-N-(3-bromo-5-methylphenyl)benzamide

3-bromo-N-(3-bromo-5-methylphenyl)benzamide (PubChem CID 107583869) has the molecular formula C14H11Br2NO and a molecular weight of 369.06 g/mol. Its IUPAC name is 3-bromo-N-(3-bromo-5-methylphenyl)benzamide.

Molecular Properties

Compound Name3-bromo-N-(3-bromo-5-methylphenyl)benzamide
PubChem CID107583869
Molecular FormulaC14H11Br2NO
Molecular Weight369.06 g/mol
Exact Mass366.92
IUPAC Name3-bromo-N-(3-bromo-5-methylphenyl)benzamide
SMILESCc1cc(Br)cc(NC(=O)c2cccc(Br)c2)c1
InChIInChI=1S/C14H11Br2NO/c1-9-5-12(16)8-13(6-9)17-14(18)10-3-2-4-11(15)7-10/h2-8H,1H3,(H,17,18)
InChIKeyYJIUYFWZZCIUCR-UHFFFAOYSA-N
XLogP4.77
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.06
LogP ≤ 54.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 3-bromo-N-(3-bromo-5-methylphenyl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(3-bromo-5-methylphenyl)-3-iodobenzamide
CID 107583753
3-bromo-N-[4-[(4-methylbenzoyl)amino]phenyl]benzamide
CID 2844876
4-bromo-N-(3-bromo-5-methylphenyl)-3-methylbenzamide
CID 107583817
3-benzamido-N-(3-bromophenyl)benzamide
CID 1304486
N-(3-bromo-5-methylphenyl)-4-tert-butylbenzamide
CID 84512530
N-(3-bromo-5-methylphenyl)-3-chloro-4-methylbenzamide
CID 107583928
3-bromo-N-(3-fluoro-5-methylphenyl)-5-methylbenzamide
CID 113460801
N-(3,5-dimethylphenyl)-3-sulfanylbenzamide
CID 107021223
3-bromo-N-pyridin-4-ylbenzamide
CID 4130300
3-bromo-N-[3-(hydroxymethyl)phenyl]-5-methylbenzamide
CID 104852214
N-(3-bromo-5-methylphenyl)-4-(propylamino)benzamide
CID 107578574
4-[(3-bromobenzoyl)amino]benzoate
CID 6943789

Frequently Asked Questions

What is the IUPAC name of 3-bromo-N-(3-bromo-5-methylphenyl)benzamide?
The IUPAC name of 3-bromo-N-(3-bromo-5-methylphenyl)benzamide (CID 107583869) is 3-bromo-N-(3-bromo-5-methylphenyl)benzamide.
What is the SMILES notation for 3-bromo-N-(3-bromo-5-methylphenyl)benzamide?
The canonical SMILES for 3-bromo-N-(3-bromo-5-methylphenyl)benzamide is Cc1cc(Br)cc(NC(=O)c2cccc(Br)c2)c1.
What is the InChIKey of 3-bromo-N-(3-bromo-5-methylphenyl)benzamide?
The InChIKey is YJIUYFWZZCIUCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Br2NO/c1-9-5-12(16)8-13(6-9)17-14(18)10-3-2-4-11(15)7-10/h2-8H,1H3,(H,17,18).
What are the key properties of 3-bromo-N-(3-bromo-5-methylphenyl)benzamide?
3-bromo-N-(3-bromo-5-methylphenyl)benzamide has a molecular weight of 369.06 g/mol, XLogP of 4.77, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-N-(3-bromo-5-methylphenyl)benzamide is sourced from PubChem (CID 107583869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).