2-bromo-4-(2-methylbenzimidazol-1-yl)benzamide

C15H12BrN3O — CID 107282938

IUPAC2-bromo-4-(2-methylbenzimidazol-1-yl)benzamide
SMILESCc1nc2ccccc2n1-c1ccc(C(N)=O)c(Br)c1
InChIInChI=1S/C15H12BrN3O/c1-9-18-13-4-2-3-5-14(13)19(9)10-6-7-11(15(17)20)12(16)8-10/h2-8H,1H3,(H2,17,20)
InChIKeyJPRXKQANKTXAPX-UHFFFAOYSA-N
MW330.19 g/mol
LogP3.20
Rot. Bonds2

About 2-bromo-4-(2-methylbenzimidazol-1-yl)benzamide

2-bromo-4-(2-methylbenzimidazol-1-yl)benzamide (PubChem CID 107282938) has the molecular formula C15H12BrN3O and a molecular weight of 330.19 g/mol. Its IUPAC name is 2-bromo-4-(2-methylbenzimidazol-1-yl)benzamide.

Molecular Properties

Compound Name2-bromo-4-(2-methylbenzimidazol-1-yl)benzamide
PubChem CID107282938
Molecular FormulaC15H12BrN3O
Molecular Weight330.19 g/mol
Exact Mass329.02
IUPAC Name2-bromo-4-(2-methylbenzimidazol-1-yl)benzamide
SMILESCc1nc2ccccc2n1-c1ccc(C(N)=O)c(Br)c1
InChIInChI=1S/C15H12BrN3O/c1-9-18-13-4-2-3-5-14(13)19(9)10-6-7-11(15(17)20)12(16)8-10/h2-8H,1H3,(H2,17,20)
InChIKeyJPRXKQANKTXAPX-UHFFFAOYSA-N
XLogP3.20
TPSA60.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.19
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-bromo-4-(2-methylbenzimidazol-1-yl)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

2-methyl-4-(2-methylbenzimidazol-1-yl)benzamide
CID 81276129
(2-bromophenyl)-(2-methylbenzimidazol-1-yl)methanone
CID 791448
1-(2-bromophenyl)-2-methylbenzimidazole
CID 168938830
2-methyl-1-(8-methyldibenzofuran-2-yl)benzimidazole
CID 122468290
2-bromo-4-pyrazol-1-ylbenzamide
CID 107282932
3-(3-bromo-4-chlorophenyl)-2-methylbenzimidazole-5-carboxylic acid
CID 82774779
N-(1-cyclopentylpiperidin-4-yl)-N,2-dimethyl-4-(2-methylbenzimidazol-1-yl)benzamide
CID 68761815
2-[4-(2-methylbenzimidazol-1-yl)phenyl]ethanamine
CID 82513889
1-(4-bromo-3-methylphenyl)-2-methylbenzimidazole-4-carboxylic acid
CID 115542830
N,2-dimethyl-4-(2-methylbenzimidazol-1-yl)-N-(1-propan-2-ylpyrrolidin-3-yl)benzamide
CID 68761872
1-(3-bromo-2-pyridinyl)-2-methylbenzimidazole
CID 79753555
2-methyl-1-[4-(10-triphenylen-2-ylanthracen-9-yl)phenyl]benzimidazole
CID 139519819

Frequently Asked Questions

What is the IUPAC name of 2-bromo-4-(2-methylbenzimidazol-1-yl)benzamide?
The IUPAC name of 2-bromo-4-(2-methylbenzimidazol-1-yl)benzamide (CID 107282938) is 2-bromo-4-(2-methylbenzimidazol-1-yl)benzamide.
What is the SMILES notation for 2-bromo-4-(2-methylbenzimidazol-1-yl)benzamide?
The canonical SMILES for 2-bromo-4-(2-methylbenzimidazol-1-yl)benzamide is Cc1nc2ccccc2n1-c1ccc(C(N)=O)c(Br)c1.
What is the InChIKey of 2-bromo-4-(2-methylbenzimidazol-1-yl)benzamide?
The InChIKey is JPRXKQANKTXAPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12BrN3O/c1-9-18-13-4-2-3-5-14(13)19(9)10-6-7-11(15(17)20)12(16)8-10/h2-8H,1H3,(H2,17,20).
What are the key properties of 2-bromo-4-(2-methylbenzimidazol-1-yl)benzamide?
2-bromo-4-(2-methylbenzimidazol-1-yl)benzamide has a molecular weight of 330.19 g/mol, XLogP of 3.20, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-4-(2-methylbenzimidazol-1-yl)benzamide is sourced from PubChem (CID 107282938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).