1-fluoro-2-(1-thiophen-2-ylcyclohexyl)ethanol

C12H17FOS — CID 174672038

IUPAC1-fluoro-2-(1-thiophen-2-ylcyclohexyl)ethanol
SMILESOC(F)CC1(c2cccs2)CCCCC1
InChIInChI=1S/C12H17FOS/c13-11(14)9-12(6-2-1-3-7-12)10-5-4-8-15-10/h4-5,8,11,14H,1-3,6-7,9H2
InChIKeyXSQXYKPBDLYPEH-UHFFFAOYSA-N
MW228.33 g/mol
LogP3.63
Rot. Bonds3

About 1-fluoro-2-(1-thiophen-2-ylcyclohexyl)ethanol

1-fluoro-2-(1-thiophen-2-ylcyclohexyl)ethanol (PubChem CID 174672038) has the molecular formula C12H17FOS and a molecular weight of 228.33 g/mol. Its IUPAC name is 1-fluoro-2-(1-thiophen-2-ylcyclohexyl)ethanol.

Molecular Properties

Compound Name1-fluoro-2-(1-thiophen-2-ylcyclohexyl)ethanol
PubChem CID174672038
Molecular FormulaC12H17FOS
Molecular Weight228.33 g/mol
Exact Mass228.10
IUPAC Name1-fluoro-2-(1-thiophen-2-ylcyclohexyl)ethanol
SMILESOC(F)CC1(c2cccs2)CCCCC1
InChIInChI=1S/C12H17FOS/c13-11(14)9-12(6-2-1-3-7-12)10-5-4-8-15-10/h4-5,8,11,14H,1-3,6-7,9H2
InChIKeyXSQXYKPBDLYPEH-UHFFFAOYSA-N
XLogP3.63
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.33
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-fluoro-2-(1-thiophen-2-ylcyclohexyl)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-Thienyl)cyclohexanol
CID 2760612
rac-[(1R,2R)-2-(thiophen-2-yl)cyclopropyl]methanol
CID 67942345
4-(Thiophen-2-yl)butan-1-ol
CID 12623862
(2R)-2-fluoro-3-thiophen-2-ylpropan-1-ol
CID 155930775
3-Methyl-5-(2-thienyl)pentanol
CID 23272364
2-(4-Phenylthiophen-2-yl)ethanol
CID 125484470
2-Thiophenepentanol
CID 12197744
6-(2-Thienyl)hexanol
CID 12197745
6-(Thiophen-3-yl)hexan-1-ol
CID 13557546
3-(3-Methylthiophen-2-yl)propan-1-ol
CID 55267212
2-Phenyl-2-thiophen-3-ylethanol
CID 69946047
3-(4-Fluorophenyl)-2-thiophen-2-ylpropan-1-ol
CID 24269167

Frequently Asked Questions

What is the IUPAC name of 1-fluoro-2-(1-thiophen-2-ylcyclohexyl)ethanol?
The IUPAC name of 1-fluoro-2-(1-thiophen-2-ylcyclohexyl)ethanol (CID 174672038) is 1-fluoro-2-(1-thiophen-2-ylcyclohexyl)ethanol.
What is the SMILES notation for 1-fluoro-2-(1-thiophen-2-ylcyclohexyl)ethanol?
The canonical SMILES for 1-fluoro-2-(1-thiophen-2-ylcyclohexyl)ethanol is OC(F)CC1(c2cccs2)CCCCC1.
What is the InChIKey of 1-fluoro-2-(1-thiophen-2-ylcyclohexyl)ethanol?
The InChIKey is XSQXYKPBDLYPEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17FOS/c13-11(14)9-12(6-2-1-3-7-12)10-5-4-8-15-10/h4-5,8,11,14H,1-3,6-7,9H2.
What are the key properties of 1-fluoro-2-(1-thiophen-2-ylcyclohexyl)ethanol?
1-fluoro-2-(1-thiophen-2-ylcyclohexyl)ethanol has a molecular weight of 228.33 g/mol, XLogP of 3.63, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-2-(1-thiophen-2-ylcyclohexyl)ethanol is sourced from PubChem (CID 174672038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).