1-(5-fluoro-2-methylphenyl)-1-(3-methylthiophen-2-yl)ethanol

C14H15FOS — CID 63991310

IUPAC1-(5-fluoro-2-methylphenyl)-1-(3-methylthiophen-2-yl)ethanol
SMILESCc1ccc(F)cc1C(C)(O)c1sccc1C
InChIInChI=1S/C14H15FOS/c1-9-4-5-11(15)8-12(9)14(3,16)13-10(2)6-7-17-13/h4-8,16H,1-3H3
InChIKeyZTCWNCPPHUUZOC-UHFFFAOYSA-N
MW250.34 g/mol
LogP3.76
Rot. Bonds2

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

1-(5-fluoro-2-methylphenyl)-1-(3-methylthiophen-2-yl)ethanol (PubChem CID 63991310) has the molecular formula C14H15FOS and a molecular weight of 250.34 g/mol. Its IUPAC name is 1-(5-fluoro-2-methylphenyl)-1-(3-methylthiophen-2-yl)ethanol.

Molecular Properties

Compound Name1-(5-fluoro-2-methylphenyl)-1-(3-methylthiophen-2-yl)ethanol
PubChem CID63991310
Molecular FormulaC14H15FOS
Molecular Weight250.34 g/mol
Exact Mass250.08
IUPAC Name1-(5-fluoro-2-methylphenyl)-1-(3-methylthiophen-2-yl)ethanol
SMILESCc1ccc(F)cc1C(C)(O)c1sccc1C
InChIInChI=1S/C14H15FOS/c1-9-4-5-11(15)8-12(9)14(3,16)13-10(2)6-7-17-13/h4-8,16H,1-3H3
InChIKeyZTCWNCPPHUUZOC-UHFFFAOYSA-N
XLogP3.76
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,5-dimethylphenyl)-1-(3-methylthiophen-2-yl)ethanol
CID 63990708
1-(5-bromo-2-fluorophenyl)-1-(3-methylthiophen-2-yl)ethanol
CID 79742355
1-(2-fluoro-3-methoxyphenyl)-1-(3-methylthiophen-2-yl)ethanol
CID 82805823
1-(3-methylthiophen-2-yl)-1-[4-(trifluoromethyl)thiophen-3-yl]ethanol
CID 112745483
1-(5-fluoro-3-pyridinyl)-1-(3-methylthiophen-2-yl)ethanol
CID 63992110
1-(3-methylthiophen-2-yl)-1-phenylethanol
CID 63991510
1-[2-chloro-6-(trifluoromethyl)-3-pyridinyl]-1-(3-methylthiophen-2-yl)ethanol
CID 106971561
2-(1,1-difluoroethyl)-4-fluoro-1-methylbenzene
CID 143135341
4-[1-hydroxy-1-(3-methylthiophen-2-yl)ethyl]benzonitrile
CID 113318948
1-(2,6-difluorophenyl)-2-(3-methylthiophen-2-yl)propan-2-ol
CID 114931026
1-(1-methylpyrazol-3-yl)-1-(3-methylthiophen-2-yl)ethanol
CID 103130169
1,1,1-trifluoro-4-(5-fluoro-2-methylphenyl)-2,4-dimethylpentan-2-ol
CID 91089694

Frequently Asked Questions

What is the IUPAC name of 1-(5-fluoro-2-methylphenyl)-1-(3-methylthiophen-2-yl)ethanol?
The IUPAC name of 1-(5-fluoro-2-methylphenyl)-1-(3-methylthiophen-2-yl)ethanol (CID 63991310) is 1-(5-fluoro-2-methylphenyl)-1-(3-methylthiophen-2-yl)ethanol.
What is the SMILES notation for 1-(5-fluoro-2-methylphenyl)-1-(3-methylthiophen-2-yl)ethanol?
The canonical SMILES for 1-(5-fluoro-2-methylphenyl)-1-(3-methylthiophen-2-yl)ethanol is Cc1ccc(F)cc1C(C)(O)c1sccc1C.
What is the InChIKey of 1-(5-fluoro-2-methylphenyl)-1-(3-methylthiophen-2-yl)ethanol?
The InChIKey is ZTCWNCPPHUUZOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FOS/c1-9-4-5-11(15)8-12(9)14(3,16)13-10(2)6-7-17-13/h4-8,16H,1-3H3.
What are the key properties of 1-(5-fluoro-2-methylphenyl)-1-(3-methylthiophen-2-yl)ethanol?
1-(5-fluoro-2-methylphenyl)-1-(3-methylthiophen-2-yl)ethanol has a molecular weight of 250.34 g/mol, XLogP of 3.76, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-fluoro-2-methylphenyl)-1-(3-methylthiophen-2-yl)ethanol is sourced from PubChem (CID 63991310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).