2-(furan-2-yl)-1H-imidazole

C7H6N2O — CID 665341

IUPAC2-(furan-2-yl)-1H-imidazole
SMILESc1coc(-c2ncc[nH]2)c1
InChIInChI=1S/C7H6N2O/c1-2-6(10-5-1)7-8-3-4-9-7/h1-5H,(H,8,9)
InChIKeyUJZPJVGOWHZIKX-UHFFFAOYSA-N
MW134.14 g/mol
LogP1.67
Rot. Bonds1

About 2-(furan-2-yl)-1H-imidazole

2-(furan-2-yl)-1H-imidazole (PubChem CID 665341) has the molecular formula C7H6N2O and a molecular weight of 134.14 g/mol. Its IUPAC name is 2-(furan-2-yl)-1H-imidazole.

Molecular Properties

Compound Name2-(furan-2-yl)-1H-imidazole
PubChem CID665341
Molecular FormulaC7H6N2O
Molecular Weight134.14 g/mol
Exact Mass134.05
IUPAC Name2-(furan-2-yl)-1H-imidazole
SMILESc1coc(-c2ncc[nH]2)c1
InChIInChI=1S/C7H6N2O/c1-2-6(10-5-1)7-8-3-4-9-7/h1-5H,(H,8,9)
InChIKeyUJZPJVGOWHZIKX-UHFFFAOYSA-N
XLogP1.67
TPSA41.82 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.14
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-1H-imidazole?
The IUPAC name of 2-(furan-2-yl)-1H-imidazole (CID 665341) is 2-(furan-2-yl)-1H-imidazole.
What is the SMILES notation for 2-(furan-2-yl)-1H-imidazole?
The canonical SMILES for 2-(furan-2-yl)-1H-imidazole is c1coc(-c2ncc[nH]2)c1.
What is the InChIKey of 2-(furan-2-yl)-1H-imidazole?
The InChIKey is UJZPJVGOWHZIKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6N2O/c1-2-6(10-5-1)7-8-3-4-9-7/h1-5H,(H,8,9).
What are the key properties of 2-(furan-2-yl)-1H-imidazole?
2-(furan-2-yl)-1H-imidazole has a molecular weight of 134.14 g/mol, XLogP of 1.67, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-1H-imidazole is sourced from PubChem (CID 665341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).