1-(2-fluoro-6-methoxyphenyl)-1-(5-methylthiophen-3-yl)ethanol

C14H15FO2S — CID 113389290

IUPAC1-(2-fluoro-6-methoxyphenyl)-1-(5-methylthiophen-3-yl)ethanol
SMILESCOc1cccc(F)c1C(C)(O)c1csc(C)c1
InChIInChI=1S/C14H15FO2S/c1-9-7-10(8-18-9)14(2,16)13-11(15)5-4-6-12(13)17-3/h4-8,16H,1-3H3
InChIKeyQPUUOBYPYXXFNK-UHFFFAOYSA-N
MW266.34 g/mol
LogP3.46
Rot. Bonds3

About 1-(2-fluoro-6-methoxyphenyl)-1-(5-methylthiophen-3-yl)ethanol

1-(2-fluoro-6-methoxyphenyl)-1-(5-methylthiophen-3-yl)ethanol (PubChem CID 113389290) has the molecular formula C14H15FO2S and a molecular weight of 266.34 g/mol. Its IUPAC name is 1-(2-fluoro-6-methoxyphenyl)-1-(5-methylthiophen-3-yl)ethanol.

Molecular Properties

Compound Name1-(2-fluoro-6-methoxyphenyl)-1-(5-methylthiophen-3-yl)ethanol
PubChem CID113389290
Molecular FormulaC14H15FO2S
Molecular Weight266.34 g/mol
Exact Mass266.08
IUPAC Name1-(2-fluoro-6-methoxyphenyl)-1-(5-methylthiophen-3-yl)ethanol
SMILESCOc1cccc(F)c1C(C)(O)c1csc(C)c1
InChIInChI=1S/C14H15FO2S/c1-9-7-10(8-18-9)14(2,16)13-11(15)5-4-6-12(13)17-3/h4-8,16H,1-3H3
InChIKeyQPUUOBYPYXXFNK-UHFFFAOYSA-N
XLogP3.46
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-fluoro-6-methoxyphenyl)-1-(3-propylphenyl)ethanol
CID 116542850
1-(3,5-difluorophenyl)-1-(2,6-dimethoxyphenyl)ethanol
CID 116809791
4-amino-2-(2-fluoro-6-methoxyphenyl)-3,3-dimethylbutan-2-ol
CID 113389409
1-(2-fluoro-6-methoxyphenyl)-1-(3-methyltriazol-4-yl)ethanol
CID 114685435
1-(4-bromo-1-methylpyrazol-5-yl)-1-(2-fluoro-6-methoxyphenyl)ethanol
CID 114638169
3-(2-fluoro-6-methoxyphenyl)-3-methylbutanoic acid
CID 117325215
3-(ethylamino)-2-(2-fluoro-6-methoxyphenyl)butan-2-ol
CID 113389301
1,1,1-trifluoro-2-(2-methoxy-6-methylphenyl)propan-2-ol
CID 83950086
1-(4-bromo-1-propan-2-ylpyrazol-5-yl)-1-(2-fluoro-6-methoxyphenyl)ethanol
CID 114638172
1-(2,6-dimethoxyphenyl)-1-(2-methoxyphenyl)ethanol
CID 116809641
1-(3-fluorophenyl)-1-(5-methylthiophen-3-yl)propan-1-ol
CID 114872384
1-(2-fluoro-3-methoxyphenyl)-1-(3-methylphenyl)ethanol
CID 82806005

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluoro-6-methoxyphenyl)-1-(5-methylthiophen-3-yl)ethanol?
The IUPAC name of 1-(2-fluoro-6-methoxyphenyl)-1-(5-methylthiophen-3-yl)ethanol (CID 113389290) is 1-(2-fluoro-6-methoxyphenyl)-1-(5-methylthiophen-3-yl)ethanol.
What is the SMILES notation for 1-(2-fluoro-6-methoxyphenyl)-1-(5-methylthiophen-3-yl)ethanol?
The canonical SMILES for 1-(2-fluoro-6-methoxyphenyl)-1-(5-methylthiophen-3-yl)ethanol is COc1cccc(F)c1C(C)(O)c1csc(C)c1.
What is the InChIKey of 1-(2-fluoro-6-methoxyphenyl)-1-(5-methylthiophen-3-yl)ethanol?
The InChIKey is QPUUOBYPYXXFNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FO2S/c1-9-7-10(8-18-9)14(2,16)13-11(15)5-4-6-12(13)17-3/h4-8,16H,1-3H3.
What are the key properties of 1-(2-fluoro-6-methoxyphenyl)-1-(5-methylthiophen-3-yl)ethanol?
1-(2-fluoro-6-methoxyphenyl)-1-(5-methylthiophen-3-yl)ethanol has a molecular weight of 266.34 g/mol, XLogP of 3.46, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluoro-6-methoxyphenyl)-1-(5-methylthiophen-3-yl)ethanol is sourced from PubChem (CID 113389290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).