2-[[2,4-difluoro-6-(furan-2-yl)phenyl]methyl]-1H-imidazole

C14H10F2N2O — CID 90869768

IUPAC2-[[2,4-difluoro-6-(furan-2-yl)phenyl]methyl]-1H-imidazole
SMILESFc1cc(F)c(Cc2ncc[nH]2)c(-c2ccco2)c1
InChIInChI=1S/C14H10F2N2O/c15-9-6-11(13-2-1-5-19-13)10(12(16)7-9)8-14-17-3-4-18-14/h1-7H,8H2,(H,17,18)
InChIKeyJSQBYGZFHKOSKZ-UHFFFAOYSA-N
MW260.24 g/mol
LogP3.54
Rot. Bonds3

About 2-[[2,4-difluoro-6-(furan-2-yl)phenyl]methyl]-1H-imidazole

2-[[2,4-difluoro-6-(furan-2-yl)phenyl]methyl]-1H-imidazole (PubChem CID 90869768) has the molecular formula C14H10F2N2O and a molecular weight of 260.24 g/mol. Its IUPAC name is 2-[[2,4-difluoro-6-(furan-2-yl)phenyl]methyl]-1H-imidazole.

Molecular Properties

Compound Name2-[[2,4-difluoro-6-(furan-2-yl)phenyl]methyl]-1H-imidazole
PubChem CID90869768
Molecular FormulaC14H10F2N2O
Molecular Weight260.24 g/mol
Exact Mass260.08
IUPAC Name2-[[2,4-difluoro-6-(furan-2-yl)phenyl]methyl]-1H-imidazole
SMILESFc1cc(F)c(Cc2ncc[nH]2)c(-c2ccco2)c1
InChIInChI=1S/C14H10F2N2O/c15-9-6-11(13-2-1-5-19-13)10(12(16)7-9)8-14-17-3-4-18-14/h1-7H,8H2,(H,17,18)
InChIKeyJSQBYGZFHKOSKZ-UHFFFAOYSA-N
XLogP3.54
TPSA41.82 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.24
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[[2,4-difluoro-6-(furan-2-yl)phenyl]methyl]-1H-imidazole?
The IUPAC name of 2-[[2,4-difluoro-6-(furan-2-yl)phenyl]methyl]-1H-imidazole (CID 90869768) is 2-[[2,4-difluoro-6-(furan-2-yl)phenyl]methyl]-1H-imidazole.
What is the SMILES notation for 2-[[2,4-difluoro-6-(furan-2-yl)phenyl]methyl]-1H-imidazole?
The canonical SMILES for 2-[[2,4-difluoro-6-(furan-2-yl)phenyl]methyl]-1H-imidazole is Fc1cc(F)c(Cc2ncc[nH]2)c(-c2ccco2)c1.
What is the InChIKey of 2-[[2,4-difluoro-6-(furan-2-yl)phenyl]methyl]-1H-imidazole?
The InChIKey is JSQBYGZFHKOSKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10F2N2O/c15-9-6-11(13-2-1-5-19-13)10(12(16)7-9)8-14-17-3-4-18-14/h1-7H,8H2,(H,17,18).
What are the key properties of 2-[[2,4-difluoro-6-(furan-2-yl)phenyl]methyl]-1H-imidazole?
2-[[2,4-difluoro-6-(furan-2-yl)phenyl]methyl]-1H-imidazole has a molecular weight of 260.24 g/mol, XLogP of 3.54, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2,4-difluoro-6-(furan-2-yl)phenyl]methyl]-1H-imidazole is sourced from PubChem (CID 90869768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).