3-bromo-N-(6-methyl-2-oxo-1,3-dihydrobenzimidazol-5-yl)benzamide

C15H12BrN3O2 — CID 110867241

IUPAC3-bromo-N-(6-methyl-2-oxo-1,3-dihydrobenzimidazol-5-yl)benzamide
SMILESCc1cc2[nH]c(=O)[nH]c2cc1NC(=O)c1cccc(Br)c1
InChIInChI=1S/C15H12BrN3O2/c1-8-5-12-13(19-15(21)18-12)7-11(8)17-14(20)9-3-2-4-10(16)6-9/h2-7H,1H3,(H,17,20)(H2,18,19,21)
InChIKeyHUCVFSWANBLRNS-UHFFFAOYSA-N
MW346.18 g/mol
LogP3.18
Rot. Bonds2

About 3-bromo-N-(6-methyl-2-oxo-1,3-dihydrobenzimidazol-5-yl)benzamide

3-bromo-N-(6-methyl-2-oxo-1,3-dihydrobenzimidazol-5-yl)benzamide (PubChem CID 110867241) has the molecular formula C15H12BrN3O2 and a molecular weight of 346.18 g/mol. Its IUPAC name is 3-bromo-N-(6-methyl-2-oxo-1,3-dihydrobenzimidazol-5-yl)benzamide.

Molecular Properties

Compound Name3-bromo-N-(6-methyl-2-oxo-1,3-dihydrobenzimidazol-5-yl)benzamide
PubChem CID110867241
Molecular FormulaC15H12BrN3O2
Molecular Weight346.18 g/mol
Exact Mass345.01
IUPAC Name3-bromo-N-(6-methyl-2-oxo-1,3-dihydrobenzimidazol-5-yl)benzamide
SMILESCc1cc2[nH]c(=O)[nH]c2cc1NC(=O)c1cccc(Br)c1
InChIInChI=1S/C15H12BrN3O2/c1-8-5-12-13(19-15(21)18-12)7-11(8)17-14(20)9-3-2-4-10(16)6-9/h2-7H,1H3,(H,17,20)(H2,18,19,21)
InChIKeyHUCVFSWANBLRNS-UHFFFAOYSA-N
XLogP3.18
TPSA77.75 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.18
LogP ≤ 53.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

3-bromo-N-[4-[4-[(3-bromobenzoyl)amino]-3-methylphenyl]-2-methylphenyl]benzamide
CID 4586964
N-(2,3-dimethylphenyl)-2-oxo-1,3-dihydrobenzimidazole-5-carboxamide
CID 110692364
N-(6-methyl-2-oxo-1,3-dihydrobenzimidazol-5-yl)-4-propan-2-ylbenzamide
CID 110867247
3-bromo-N-(4,7-dimethyl-2-oxochromen-6-yl)benzamide
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N-(5-amino-2-bromo-4-methylphenyl)-3-bromobenzamide
CID 104814581
3-bromo-N-[2-methyl-5-(trifluoromethyl)phenyl]benzamide
CID 66477560
2-fluoro-N-(6-methyl-2-oxo-1,3-dihydrobenzimidazol-5-yl)benzamide
CID 16765362
3-bromo-N-(6-methyl-2-phenylbenzotriazol-5-yl)benzamide
CID 1348241
N-(5-bromo-2-methylphenyl)-3-iodobenzamide
CID 43806317
3-bromo-N-[5-(N'-hydroxycarbamimidoyl)-2-methylphenyl]benzamide
CID 76935570
3-bromo-N-(2-carbamothioyl-3-methylphenyl)benzamide
CID 107805603

Frequently Asked Questions

What is the IUPAC name of 3-bromo-N-(6-methyl-2-oxo-1,3-dihydrobenzimidazol-5-yl)benzamide?
The IUPAC name of 3-bromo-N-(6-methyl-2-oxo-1,3-dihydrobenzimidazol-5-yl)benzamide (CID 110867241) is 3-bromo-N-(6-methyl-2-oxo-1,3-dihydrobenzimidazol-5-yl)benzamide.
What is the SMILES notation for 3-bromo-N-(6-methyl-2-oxo-1,3-dihydrobenzimidazol-5-yl)benzamide?
The canonical SMILES for 3-bromo-N-(6-methyl-2-oxo-1,3-dihydrobenzimidazol-5-yl)benzamide is Cc1cc2[nH]c(=O)[nH]c2cc1NC(=O)c1cccc(Br)c1.
What is the InChIKey of 3-bromo-N-(6-methyl-2-oxo-1,3-dihydrobenzimidazol-5-yl)benzamide?
The InChIKey is HUCVFSWANBLRNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12BrN3O2/c1-8-5-12-13(19-15(21)18-12)7-11(8)17-14(20)9-3-2-4-10(16)6-9/h2-7H,1H3,(H,17,20)(H2,18,19,21).
What are the key properties of 3-bromo-N-(6-methyl-2-oxo-1,3-dihydrobenzimidazol-5-yl)benzamide?
3-bromo-N-(6-methyl-2-oxo-1,3-dihydrobenzimidazol-5-yl)benzamide has a molecular weight of 346.18 g/mol, XLogP of 3.18, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-N-(6-methyl-2-oxo-1,3-dihydrobenzimidazol-5-yl)benzamide is sourced from PubChem (CID 110867241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).