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

C14H12N2O — CID 977250

IUPAC1-benzyl-2-(furan-2-yl)imidazole
SMILESc1ccc(Cn2ccnc2-c2ccco2)cc1
InChIInChI=1S/C14H12N2O/c1-2-5-12(6-3-1)11-16-9-8-15-14(16)13-7-4-10-17-13/h1-10H,11H2
InChIKeyXDSFJXOLVUTTJG-UHFFFAOYSA-N
MW224.26 g/mol
LogP3.19
Rot. Bonds3

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

1-benzyl-2-(furan-2-yl)imidazole (PubChem CID 977250) has the molecular formula C14H12N2O and a molecular weight of 224.26 g/mol. Its IUPAC name is 1-benzyl-2-(furan-2-yl)imidazole.

Molecular Properties

Compound Name1-benzyl-2-(furan-2-yl)imidazole
PubChem CID977250
Molecular FormulaC14H12N2O
Molecular Weight224.26 g/mol
Exact Mass224.09
IUPAC Name1-benzyl-2-(furan-2-yl)imidazole
SMILESc1ccc(Cn2ccnc2-c2ccco2)cc1
InChIInChI=1S/C14H12N2O/c1-2-5-12(6-3-1)11-16-9-8-15-14(16)13-7-4-10-17-13/h1-10H,11H2
InChIKeyXDSFJXOLVUTTJG-UHFFFAOYSA-N
XLogP3.19
TPSA30.96 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 53.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-benzyl-2-(furan-2-yl)imidazole?
The IUPAC name of 1-benzyl-2-(furan-2-yl)imidazole (CID 977250) is 1-benzyl-2-(furan-2-yl)imidazole.
What is the SMILES notation for 1-benzyl-2-(furan-2-yl)imidazole?
The canonical SMILES for 1-benzyl-2-(furan-2-yl)imidazole is c1ccc(Cn2ccnc2-c2ccco2)cc1.
What is the InChIKey of 1-benzyl-2-(furan-2-yl)imidazole?
The InChIKey is XDSFJXOLVUTTJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2O/c1-2-5-12(6-3-1)11-16-9-8-15-14(16)13-7-4-10-17-13/h1-10H,11H2.
What are the key properties of 1-benzyl-2-(furan-2-yl)imidazole?
1-benzyl-2-(furan-2-yl)imidazole has a molecular weight of 224.26 g/mol, XLogP of 3.19, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-2-(furan-2-yl)imidazole is sourced from PubChem (CID 977250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).