2-[(E)-2-(furan-2-yl)ethenyl]-1H-benzimidazole

C13H10N2O — CID 5343732

IUPAC2-[(E)-2-(furan-2-yl)ethenyl]-1H-benzimidazole
SMILESC(=C/c1ccco1)\c1nc2ccccc2[nH]1
InChIInChI=1S/C13H10N2O/c1-2-6-12-11(5-1)14-13(15-12)8-7-10-4-3-9-16-10/h1-9H,(H,14,15)/b8-7+
InChIKeyLPLLNBVBHIZVJV-BQYQJAHWSA-N
MW210.24 g/mol
LogP3.33
Rot. Bonds2

About 2-[(E)-2-(furan-2-yl)ethenyl]-1H-benzimidazole

2-[(E)-2-(furan-2-yl)ethenyl]-1H-benzimidazole (PubChem CID 5343732) has the molecular formula C13H10N2O and a molecular weight of 210.24 g/mol. Its IUPAC name is 2-[(E)-2-(furan-2-yl)ethenyl]-1H-benzimidazole.

Molecular Properties

Compound Name2-[(E)-2-(furan-2-yl)ethenyl]-1H-benzimidazole
PubChem CID5343732
Molecular FormulaC13H10N2O
Molecular Weight210.24 g/mol
Exact Mass210.08
IUPAC Name2-[(E)-2-(furan-2-yl)ethenyl]-1H-benzimidazole
SMILESC(=C/c1ccco1)\c1nc2ccccc2[nH]1
InChIInChI=1S/C13H10N2O/c1-2-6-12-11(5-1)14-13(15-12)8-7-10-4-3-9-16-10/h1-9H,(H,14,15)/b8-7+
InChIKeyLPLLNBVBHIZVJV-BQYQJAHWSA-N
XLogP3.33
TPSA41.82 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.24
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[(E)-2-(furan-2-yl)ethenyl]-1H-benzimidazole?
The IUPAC name of 2-[(E)-2-(furan-2-yl)ethenyl]-1H-benzimidazole (CID 5343732) is 2-[(E)-2-(furan-2-yl)ethenyl]-1H-benzimidazole.
What is the SMILES notation for 2-[(E)-2-(furan-2-yl)ethenyl]-1H-benzimidazole?
The canonical SMILES for 2-[(E)-2-(furan-2-yl)ethenyl]-1H-benzimidazole is C(=C/c1ccco1)\c1nc2ccccc2[nH]1.
What is the InChIKey of 2-[(E)-2-(furan-2-yl)ethenyl]-1H-benzimidazole?
The InChIKey is LPLLNBVBHIZVJV-BQYQJAHWSA-N. The full InChI is InChI=1S/C13H10N2O/c1-2-6-12-11(5-1)14-13(15-12)8-7-10-4-3-9-16-10/h1-9H,(H,14,15)/b8-7+.
What are the key properties of 2-[(E)-2-(furan-2-yl)ethenyl]-1H-benzimidazole?
2-[(E)-2-(furan-2-yl)ethenyl]-1H-benzimidazole has a molecular weight of 210.24 g/mol, XLogP of 3.33, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(E)-2-(furan-2-yl)ethenyl]-1H-benzimidazole is sourced from PubChem (CID 5343732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).