4-methyl-3-(2-methylphenyl)-1H-benzimidazol-2-one

C15H14N2O — CID 117209197

IUPAC4-methyl-3-(2-methylphenyl)-1H-benzimidazol-2-one
SMILESCc1ccccc1-n1c(=O)[nH]c2cccc(C)c21
InChIInChI=1S/C15H14N2O/c1-10-6-3-4-9-13(10)17-14-11(2)7-5-8-12(14)16-15(17)18/h3-9H,1-2H3,(H,16,18)
InChIKeyHZFZXLHJQDMMFS-UHFFFAOYSA-N
MW238.29 g/mol
LogP2.94
Rot. Bonds1

About 4-methyl-3-(2-methylphenyl)-1H-benzimidazol-2-one

4-methyl-3-(2-methylphenyl)-1H-benzimidazol-2-one (PubChem CID 117209197) has the molecular formula C15H14N2O and a molecular weight of 238.29 g/mol. Its IUPAC name is 4-methyl-3-(2-methylphenyl)-1H-benzimidazol-2-one.

Molecular Properties

Compound Name4-methyl-3-(2-methylphenyl)-1H-benzimidazol-2-one
PubChem CID117209197
Molecular FormulaC15H14N2O
Molecular Weight238.29 g/mol
Exact Mass238.11
IUPAC Name4-methyl-3-(2-methylphenyl)-1H-benzimidazol-2-one
SMILESCc1ccccc1-n1c(=O)[nH]c2cccc(C)c21
InChIInChI=1S/C15H14N2O/c1-10-6-3-4-9-13(10)17-14-11(2)7-5-8-12(14)16-15(17)18/h3-9H,1-2H3,(H,16,18)
InChIKeyHZFZXLHJQDMMFS-UHFFFAOYSA-N
XLogP2.94
TPSA37.79 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,3-dimethyl-5-(7-methyl-2-oxo-3H-benzimidazol-1-yl)pyridine-4-carboxamide
CID 175073755
3-(3-hydroxyphenyl)-4-methyl-1H-benzimidazol-2-one
CID 117209156
4-methyl-3-[4-(trifluoromethyl)phenyl]-1H-benzimidazol-2-one
CID 117209238
3-(2,3-dimethylphenyl)-1H-quinazoline-2,4-dione
CID 12845269
3-(2-methylphenyl)-1H-thieno[3,2-d]pyrimidine-2,4-dione
CID 45030940
7-methyl-2-oxo-3H-benzimidazole-1-carboxylic acid
CID 154197959
3-(2-chlorophenyl)-4-methoxy-1H-benzimidazol-2-one
CID 117209227
4-fluoro-3-(2-methoxyphenyl)-1H-benzimidazol-2-one
CID 117209214
3-(2-hydroxyphenyl)-4-(trifluoromethyl)-1H-benzimidazol-2-one
CID 117209194
methyl 5-(7-methyl-2-oxo-3H-benzimidazol-1-yl)pyridine-2-carboxylate
CID 146175415
3-[(2-chlorophenyl)methyl]-4-methyl-1H-benzimidazol-2-one
CID 117209046
3-(2,6-dimethylphenyl)-4,5-difluoro-1H-benzimidazol-2-one
CID 110491340

Frequently Asked Questions

What is the IUPAC name of 4-methyl-3-(2-methylphenyl)-1H-benzimidazol-2-one?
The IUPAC name of 4-methyl-3-(2-methylphenyl)-1H-benzimidazol-2-one (CID 117209197) is 4-methyl-3-(2-methylphenyl)-1H-benzimidazol-2-one.
What is the SMILES notation for 4-methyl-3-(2-methylphenyl)-1H-benzimidazol-2-one?
The canonical SMILES for 4-methyl-3-(2-methylphenyl)-1H-benzimidazol-2-one is Cc1ccccc1-n1c(=O)[nH]c2cccc(C)c21.
What is the InChIKey of 4-methyl-3-(2-methylphenyl)-1H-benzimidazol-2-one?
The InChIKey is HZFZXLHJQDMMFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O/c1-10-6-3-4-9-13(10)17-14-11(2)7-5-8-12(14)16-15(17)18/h3-9H,1-2H3,(H,16,18).
What are the key properties of 4-methyl-3-(2-methylphenyl)-1H-benzimidazol-2-one?
4-methyl-3-(2-methylphenyl)-1H-benzimidazol-2-one has a molecular weight of 238.29 g/mol, XLogP of 2.94, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-3-(2-methylphenyl)-1H-benzimidazol-2-one is sourced from PubChem (CID 117209197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).