furan-2-yl-(2-methylbenzimidazol-1-yl)methanone

C13H10N2O2 — CID 791341

IUPACfuran-2-yl-(2-methylbenzimidazol-1-yl)methanone
SMILESCc1nc2ccccc2n1C(=O)c1ccco1
InChIInChI=1S/C13H10N2O2/c1-9-14-10-5-2-3-6-11(10)15(9)13(16)12-7-4-8-17-12/h2-8H,1H3
InChIKeyZEQJLERROYRVNG-UHFFFAOYSA-N
MW226.24 g/mol
LogP2.63
Rot. Bonds1

About furan-2-yl-(2-methylbenzimidazol-1-yl)methanone

furan-2-yl-(2-methylbenzimidazol-1-yl)methanone (PubChem CID 791341) has the molecular formula C13H10N2O2 and a molecular weight of 226.24 g/mol. Its IUPAC name is furan-2-yl-(2-methylbenzimidazol-1-yl)methanone.

Molecular Properties

Compound Namefuran-2-yl-(2-methylbenzimidazol-1-yl)methanone
PubChem CID791341
Molecular FormulaC13H10N2O2
Molecular Weight226.24 g/mol
Exact Mass226.07
IUPAC Namefuran-2-yl-(2-methylbenzimidazol-1-yl)methanone
SMILESCc1nc2ccccc2n1C(=O)c1ccco1
InChIInChI=1S/C13H10N2O2/c1-9-14-10-5-2-3-6-11(10)15(9)13(16)12-7-4-8-17-12/h2-8H,1H3
InChIKeyZEQJLERROYRVNG-UHFFFAOYSA-N
XLogP2.63
TPSA48.03 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.24
LogP ≤ 52.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of furan-2-yl-(2-methylbenzimidazol-1-yl)methanone?
The IUPAC name of furan-2-yl-(2-methylbenzimidazol-1-yl)methanone (CID 791341) is furan-2-yl-(2-methylbenzimidazol-1-yl)methanone.
What is the SMILES notation for furan-2-yl-(2-methylbenzimidazol-1-yl)methanone?
The canonical SMILES for furan-2-yl-(2-methylbenzimidazol-1-yl)methanone is Cc1nc2ccccc2n1C(=O)c1ccco1.
What is the InChIKey of furan-2-yl-(2-methylbenzimidazol-1-yl)methanone?
The InChIKey is ZEQJLERROYRVNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N2O2/c1-9-14-10-5-2-3-6-11(10)15(9)13(16)12-7-4-8-17-12/h2-8H,1H3.
What are the key properties of furan-2-yl-(2-methylbenzimidazol-1-yl)methanone?
furan-2-yl-(2-methylbenzimidazol-1-yl)methanone has a molecular weight of 226.24 g/mol, XLogP of 2.63, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for furan-2-yl-(2-methylbenzimidazol-1-yl)methanone is sourced from PubChem (CID 791341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).