benzimidazol-1-yl(1H-imidazol-2-yl)methanone

C11H8N4O — CID 110466447

IUPACbenzimidazol-1-yl(1H-imidazol-2-yl)methanone
SMILESO=C(c1ncc[nH]1)n1cnc2ccccc21
InChIInChI=1S/C11H8N4O/c16-11(10-12-5-6-13-10)15-7-14-8-3-1-2-4-9(8)15/h1-7H,(H,12,13)
InChIKeyKQGJSYRGJNGKES-UHFFFAOYSA-N
MW212.21 g/mol
LogP1.45
Rot. Bonds1

About benzimidazol-1-yl(1H-imidazol-2-yl)methanone

benzimidazol-1-yl(1H-imidazol-2-yl)methanone (PubChem CID 110466447) has the molecular formula C11H8N4O and a molecular weight of 212.21 g/mol. Its IUPAC name is benzimidazol-1-yl(1H-imidazol-2-yl)methanone.

Molecular Properties

Compound Namebenzimidazol-1-yl(1H-imidazol-2-yl)methanone
PubChem CID110466447
Molecular FormulaC11H8N4O
Molecular Weight212.21 g/mol
Exact Mass212.07
IUPAC Namebenzimidazol-1-yl(1H-imidazol-2-yl)methanone
SMILESO=C(c1ncc[nH]1)n1cnc2ccccc21
InChIInChI=1S/C11H8N4O/c16-11(10-12-5-6-13-10)15-7-14-8-3-1-2-4-9(8)15/h1-7H,(H,12,13)
InChIKeyKQGJSYRGJNGKES-UHFFFAOYSA-N
XLogP1.45
TPSA63.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.21
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

benzimidazol-1-yl-(4-methylphenyl)methanone
CID 710618
benzimidazol-1-yl(1,3-thiazol-4-yl)methanone
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benzimidazol-1-yl(imidazo[1,2-a]pyridin-8-yl)methanone
CID 110475069
(5-aminofuran-2-yl)-(benzimidazol-1-yl)methanone
CID 82344378
benzimidazol-1-yl-(3,4-dimethylphenyl)methanone
CID 741948
benzimidazol-1-yl(1H-indazol-4-yl)methanone
CID 110468713
N-phenylbenzimidazole-1-carboxamide
CID 13125705
1-(benzimidazol-1-yl)-2-[[2-(benzimidazol-1-yl)-2-oxoethyl]sulfanylmethylsulfanyl]ethanone
CID 3845970
1-(benzimidazol-1-yl)-2-(methylamino)ethanone
CID 110460341
bromomethyl benzimidazole-1-carboxylate
CID 135347541
N-butyl-N-methylbenzimidazole-1-carboxamide
CID 170699007
1-(benzimidazol-1-yl)-3-phenylpropan-1-one
CID 4630006

Frequently Asked Questions

What is the IUPAC name of benzimidazol-1-yl(1H-imidazol-2-yl)methanone?
The IUPAC name of benzimidazol-1-yl(1H-imidazol-2-yl)methanone (CID 110466447) is benzimidazol-1-yl(1H-imidazol-2-yl)methanone.
What is the SMILES notation for benzimidazol-1-yl(1H-imidazol-2-yl)methanone?
The canonical SMILES for benzimidazol-1-yl(1H-imidazol-2-yl)methanone is O=C(c1ncc[nH]1)n1cnc2ccccc21.
What is the InChIKey of benzimidazol-1-yl(1H-imidazol-2-yl)methanone?
The InChIKey is KQGJSYRGJNGKES-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8N4O/c16-11(10-12-5-6-13-10)15-7-14-8-3-1-2-4-9(8)15/h1-7H,(H,12,13).
What are the key properties of benzimidazol-1-yl(1H-imidazol-2-yl)methanone?
benzimidazol-1-yl(1H-imidazol-2-yl)methanone has a molecular weight of 212.21 g/mol, XLogP of 1.45, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for benzimidazol-1-yl(1H-imidazol-2-yl)methanone is sourced from PubChem (CID 110466447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).