5-benzoyl-1,3-dihydrobenzimidazol-2-one

C14H10N2O2 — CID 854379

IUPAC5-benzoyl-1,3-dihydrobenzimidazol-2-one
SMILESO=C(c1ccccc1)c1ccc2[nH]c(=O)[nH]c2c1
InChIInChI=1S/C14H10N2O2/c17-13(9-4-2-1-3-5-9)10-6-7-11-12(8-10)16-14(18)15-11/h1-8H,(H2,15,16,18)
InChIKeyHUBCTWDCEBWLBF-UHFFFAOYSA-N
MW238.25 g/mol
LogP2.09
Rot. Bonds2

About 5-benzoyl-1,3-dihydrobenzimidazol-2-one

5-benzoyl-1,3-dihydrobenzimidazol-2-one (PubChem CID 854379) has the molecular formula C14H10N2O2 and a molecular weight of 238.25 g/mol. Its IUPAC name is 5-benzoyl-1,3-dihydrobenzimidazol-2-one.

Molecular Properties

Compound Name5-benzoyl-1,3-dihydrobenzimidazol-2-one
PubChem CID854379
Molecular FormulaC14H10N2O2
Molecular Weight238.25 g/mol
Exact Mass238.07
IUPAC Name5-benzoyl-1,3-dihydrobenzimidazol-2-one
SMILESO=C(c1ccccc1)c1ccc2[nH]c(=O)[nH]c2c1
InChIInChI=1S/C14H10N2O2/c17-13(9-4-2-1-3-5-9)10-6-7-11-12(8-10)16-14(18)15-11/h1-8H,(H2,15,16,18)
InChIKeyHUBCTWDCEBWLBF-UHFFFAOYSA-N
XLogP2.09
TPSA65.72 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.25
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-[4-(methylamino)benzoyl]-1,3-dihydrobenzimidazol-2-one
CID 116917457
5-(3,4-difluorobenzoyl)-1,3-dihydrobenzimidazol-2-one
CID 43338650
6-benzoyl-3H-1,3-benzoselenazol-2-one
CID 10447623
N-methyl-2-oxo-N-phenyl-1,3-dihydrobenzimidazole-5-carboxamide
CID 110692356
5-(3-phenylpropanoyl)-1,3-dihydrobenzimidazol-2-one
CID 43338635
3-methyl-2-(2-oxo-1,3-dihydrobenzimidazole-5-carbonyl)butanoic acid
CID 116922964
N,N-dimethyl-2-oxo-1,3-dihydrobenzimidazole-5-carboxamide
CID 22745221
5-(5-chloro-2-fluorobenzoyl)-1,3-dihydrobenzimidazol-2-one
CID 43338645
5-(2,3-difluorobenzoyl)-1,3-dihydrobenzimidazol-2-one
CID 62648992
2-amino-3-oxo-3-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanoic acid
CID 116920540
diphenylmethanone
CID 3102
5-(2-aminoacetyl)-1,3-dihydrobenzimidazol-2-one;hydrochloride
CID 18002813

Frequently Asked Questions

What is the IUPAC name of 5-benzoyl-1,3-dihydrobenzimidazol-2-one?
The IUPAC name of 5-benzoyl-1,3-dihydrobenzimidazol-2-one (CID 854379) is 5-benzoyl-1,3-dihydrobenzimidazol-2-one.
What is the SMILES notation for 5-benzoyl-1,3-dihydrobenzimidazol-2-one?
The canonical SMILES for 5-benzoyl-1,3-dihydrobenzimidazol-2-one is O=C(c1ccccc1)c1ccc2[nH]c(=O)[nH]c2c1.
What is the InChIKey of 5-benzoyl-1,3-dihydrobenzimidazol-2-one?
The InChIKey is HUBCTWDCEBWLBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N2O2/c17-13(9-4-2-1-3-5-9)10-6-7-11-12(8-10)16-14(18)15-11/h1-8H,(H2,15,16,18).
What are the key properties of 5-benzoyl-1,3-dihydrobenzimidazol-2-one?
5-benzoyl-1,3-dihydrobenzimidazol-2-one has a molecular weight of 238.25 g/mol, XLogP of 2.09, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-benzoyl-1,3-dihydrobenzimidazol-2-one is sourced from PubChem (CID 854379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).