(2-fluoro-4,6-dimethylphenyl)-(2,4,5-trimethylfuran-3-yl)methanol

C16H19FO2 — CID 106884178

IUPAC(2-fluoro-4,6-dimethylphenyl)-(2,4,5-trimethylfuran-3-yl)methanol
SMILESCc1cc(C)c(C(O)c2c(C)oc(C)c2C)c(F)c1
InChIInChI=1S/C16H19FO2/c1-8-6-9(2)14(13(17)7-8)16(18)15-10(3)11(4)19-12(15)5/h6-7,16,18H,1-5H3
InChIKeyGDLRJUHVCRJKII-UHFFFAOYSA-N
MW262.32 g/mol
LogP4.04
Rot. Bonds2

About (2-fluoro-4,6-dimethylphenyl)-(2,4,5-trimethylfuran-3-yl)methanol

(2-fluoro-4,6-dimethylphenyl)-(2,4,5-trimethylfuran-3-yl)methanol (PubChem CID 106884178) has the molecular formula C16H19FO2 and a molecular weight of 262.32 g/mol. Its IUPAC name is (2-fluoro-4,6-dimethylphenyl)-(2,4,5-trimethylfuran-3-yl)methanol.

Molecular Properties

Compound Name(2-fluoro-4,6-dimethylphenyl)-(2,4,5-trimethylfuran-3-yl)methanol
PubChem CID106884178
Molecular FormulaC16H19FO2
Molecular Weight262.32 g/mol
Exact Mass262.14
IUPAC Name(2-fluoro-4,6-dimethylphenyl)-(2,4,5-trimethylfuran-3-yl)methanol
SMILESCc1cc(C)c(C(O)c2c(C)oc(C)c2C)c(F)c1
InChIInChI=1S/C16H19FO2/c1-8-6-9(2)14(13(17)7-8)16(18)15-10(3)11(4)19-12(15)5/h6-7,16,18H,1-5H3
InChIKeyGDLRJUHVCRJKII-UHFFFAOYSA-N
XLogP4.04
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.32
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2-fluoro-4,6-dimethylphenyl)-(5-methyl-1-benzofuran-2-yl)methanol
CID 106884110
(2,4,5-trimethylfuran-3-yl)-(2,4,6-trimethylphenyl)methanamine
CID 65151840
1-(2-fluoro-4,6-dimethylphenyl)-2-[(2-methylpropan-2-yl)oxy]ethanol
CID 106884137
(3-chloro-5-fluorophenyl)-(2-fluoro-4,6-dimethylphenyl)methanol
CID 106880575
(2,5-dichlorophenyl)-(2-fluoro-4,6-dimethylphenyl)methanol
CID 106884176
(2-fluoro-4,6-dimethylphenyl)-(2-methylsulfanylphenyl)methanol
CID 106884084
(2,3,4-trifluorophenyl)-(2,4,5-trimethylfuran-3-yl)methanol
CID 115796955
(7-bromo-1-benzofuran-2-yl)-(2-fluoro-4,6-dimethylphenyl)methanol
CID 106884122
(2-fluoro-4,6-dimethylphenyl)-(1H-imidazol-2-yl)methanol
CID 106881131
(5-chloro-2-pyridinyl)-(2-fluoro-4,6-dimethylphenyl)methanol
CID 106881129
(4-fluoronaphthalen-1-yl)-(2,4,5-trimethylfuran-3-yl)methanol
CID 65153464
3-(2-fluoro-4,6-dimethylphenyl)pentane-2,4-dione
CID 58964845

Frequently Asked Questions

What is the IUPAC name of (2-fluoro-4,6-dimethylphenyl)-(2,4,5-trimethylfuran-3-yl)methanol?
The IUPAC name of (2-fluoro-4,6-dimethylphenyl)-(2,4,5-trimethylfuran-3-yl)methanol (CID 106884178) is (2-fluoro-4,6-dimethylphenyl)-(2,4,5-trimethylfuran-3-yl)methanol.
What is the SMILES notation for (2-fluoro-4,6-dimethylphenyl)-(2,4,5-trimethylfuran-3-yl)methanol?
The canonical SMILES for (2-fluoro-4,6-dimethylphenyl)-(2,4,5-trimethylfuran-3-yl)methanol is Cc1cc(C)c(C(O)c2c(C)oc(C)c2C)c(F)c1.
What is the InChIKey of (2-fluoro-4,6-dimethylphenyl)-(2,4,5-trimethylfuran-3-yl)methanol?
The InChIKey is GDLRJUHVCRJKII-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19FO2/c1-8-6-9(2)14(13(17)7-8)16(18)15-10(3)11(4)19-12(15)5/h6-7,16,18H,1-5H3.
What are the key properties of (2-fluoro-4,6-dimethylphenyl)-(2,4,5-trimethylfuran-3-yl)methanol?
(2-fluoro-4,6-dimethylphenyl)-(2,4,5-trimethylfuran-3-yl)methanol has a molecular weight of 262.32 g/mol, XLogP of 4.04, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-fluoro-4,6-dimethylphenyl)-(2,4,5-trimethylfuran-3-yl)methanol is sourced from PubChem (CID 106884178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).