2-(2,5-difluorophenyl)-1-(2,4,5-trimethylfuran-3-yl)ethanol

C15H16F2O2 — CID 114981981

IUPAC2-(2,5-difluorophenyl)-1-(2,4,5-trimethylfuran-3-yl)ethanol
SMILESCc1oc(C)c(C(O)Cc2cc(F)ccc2F)c1C
InChIInChI=1S/C15H16F2O2/c1-8-9(2)19-10(3)15(8)14(18)7-11-6-12(16)4-5-13(11)17/h4-6,14,18H,7H2,1-3H3
InChIKeyVQKPXOHXSQNLEL-UHFFFAOYSA-N
MW266.29 g/mol
LogP3.76
Rot. Bonds3

About 2-(2,5-difluorophenyl)-1-(2,4,5-trimethylfuran-3-yl)ethanol

2-(2,5-difluorophenyl)-1-(2,4,5-trimethylfuran-3-yl)ethanol (PubChem CID 114981981) has the molecular formula C15H16F2O2 and a molecular weight of 266.29 g/mol. Its IUPAC name is 2-(2,5-difluorophenyl)-1-(2,4,5-trimethylfuran-3-yl)ethanol.

Molecular Properties

Compound Name2-(2,5-difluorophenyl)-1-(2,4,5-trimethylfuran-3-yl)ethanol
PubChem CID114981981
Molecular FormulaC15H16F2O2
Molecular Weight266.29 g/mol
Exact Mass266.11
IUPAC Name2-(2,5-difluorophenyl)-1-(2,4,5-trimethylfuran-3-yl)ethanol
SMILESCc1oc(C)c(C(O)Cc2cc(F)ccc2F)c1C
InChIInChI=1S/C15H16F2O2/c1-8-9(2)19-10(3)15(8)14(18)7-11-6-12(16)4-5-13(11)17/h4-6,14,18H,7H2,1-3H3
InChIKeyVQKPXOHXSQNLEL-UHFFFAOYSA-N
XLogP3.76
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.29
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(2,5-difluorophenyl)-1-(2,4,5-trimethylfuran-3-yl)ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(2,5-difluorophenyl)-1-(2,4,5-trimethylfuran-3-yl)ethanamine
CID 115809781
2-(2,5-difluorophenyl)-1-(2,4,6-trimethylphenyl)ethanol
CID 63893918
2-(3-fluorophenyl)-1-(2,4,5-trimethylfuran-3-yl)ethanol
CID 65152206
2-(2,5-difluorophenyl)-1-(2,6-dimethoxyphenyl)ethanol
CID 114981931
2-(2,5-difluorophenyl)-1-(5-methylfuran-3-yl)ethanol
CID 114982000
2-(2,5-difluorophenyl)-1-(5-methyl-3-pyridinyl)ethanol
CID 105081046
2-(2,5-difluorophenyl)-1-(2-methylpyrimidin-4-yl)ethanol
CID 115527940
1-(2,5-difluorophenyl)-3-methylbutane-2,3-diol
CID 103448861
2-(2,5-difluorophenyl)-1-(2-fluorophenyl)ethanol
CID 63083872
1-(4-chloro-3-methylphenyl)-2-(2,5-difluorophenyl)ethanol
CID 114982155
2-(2,4-difluorophenyl)-1-(4-fluoro-2,6-dimethylphenyl)ethanol
CID 106879490
2-(2,5-difluorophenyl)-1-pyridazin-4-ylethanol
CID 105081030

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-difluorophenyl)-1-(2,4,5-trimethylfuran-3-yl)ethanol?
The IUPAC name of 2-(2,5-difluorophenyl)-1-(2,4,5-trimethylfuran-3-yl)ethanol (CID 114981981) is 2-(2,5-difluorophenyl)-1-(2,4,5-trimethylfuran-3-yl)ethanol.
What is the SMILES notation for 2-(2,5-difluorophenyl)-1-(2,4,5-trimethylfuran-3-yl)ethanol?
The canonical SMILES for 2-(2,5-difluorophenyl)-1-(2,4,5-trimethylfuran-3-yl)ethanol is Cc1oc(C)c(C(O)Cc2cc(F)ccc2F)c1C.
What is the InChIKey of 2-(2,5-difluorophenyl)-1-(2,4,5-trimethylfuran-3-yl)ethanol?
The InChIKey is VQKPXOHXSQNLEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16F2O2/c1-8-9(2)19-10(3)15(8)14(18)7-11-6-12(16)4-5-13(11)17/h4-6,14,18H,7H2,1-3H3.
What are the key properties of 2-(2,5-difluorophenyl)-1-(2,4,5-trimethylfuran-3-yl)ethanol?
2-(2,5-difluorophenyl)-1-(2,4,5-trimethylfuran-3-yl)ethanol has a molecular weight of 266.29 g/mol, XLogP of 3.76, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-difluorophenyl)-1-(2,4,5-trimethylfuran-3-yl)ethanol is sourced from PubChem (CID 114981981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).