1-(5-ethylthiophen-2-yl)-2-(oxolan-2-yl)ethanol

C12H18O2S — CID 65149785

IUPAC1-(5-ethylthiophen-2-yl)-2-(oxolan-2-yl)ethanol
SMILESCCc1ccc(C(O)CC2CCCO2)s1
InChIInChI=1S/C12H18O2S/c1-2-10-5-6-12(15-10)11(13)8-9-4-3-7-14-9/h5-6,9,11,13H,2-4,7-8H2,1H3
InChIKeyGMFRAGLITSWNAG-UHFFFAOYSA-N
MW226.34 g/mol
LogP2.91
Rot. Bonds4

About 1-(5-ethylthiophen-2-yl)-2-(oxolan-2-yl)ethanol

1-(5-ethylthiophen-2-yl)-2-(oxolan-2-yl)ethanol (PubChem CID 65149785) has the molecular formula C12H18O2S and a molecular weight of 226.34 g/mol. Its IUPAC name is 1-(5-ethylthiophen-2-yl)-2-(oxolan-2-yl)ethanol.

Molecular Properties

Compound Name1-(5-ethylthiophen-2-yl)-2-(oxolan-2-yl)ethanol
PubChem CID65149785
Molecular FormulaC12H18O2S
Molecular Weight226.34 g/mol
Exact Mass226.10
IUPAC Name1-(5-ethylthiophen-2-yl)-2-(oxolan-2-yl)ethanol
SMILESCCc1ccc(C(O)CC2CCCO2)s1
InChIInChI=1S/C12H18O2S/c1-2-10-5-6-12(15-10)11(13)8-9-4-3-7-14-9/h5-6,9,11,13H,2-4,7-8H2,1H3
InChIKeyGMFRAGLITSWNAG-UHFFFAOYSA-N
XLogP2.91
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.34
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(5-ethylthiophen-2-yl)-2-(oxolan-2-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

N-ethyl-1-(5-ethylthiophen-2-yl)-2-(oxolan-2-yl)ethanamine
CID 65156624
2-[chloro-(5-ethylthiophen-2-yl)methyl]oxolane
CID 61082899
1-(5-ethylthiophen-2-yl)-N-[2-(oxolan-2-yl)ethyl]ethanamine
CID 61335920
N-ethyl-1-(5-ethylthiophen-2-yl)-3-(oxolan-2-yl)propan-2-amine
CID 62600752
2-(5-ethylthiophen-2-yl)-2-(oxolan-2-ylmethylamino)acetonitrile
CID 55062169
1-(4-methylphenyl)-2-(oxolan-2-yl)ethanol
CID 60797370
[1-(5-methylthiophen-2-yl)-2-(oxolan-2-yl)ethyl]hydrazine
CID 105198565
2-(3,4-dihydro-2H-chromen-4-yl)-1-(5-ethylthiophen-2-yl)ethanol
CID 104769223
1-[4-(2-methylbutan-2-yl)phenyl]-2-(oxolan-2-yl)ethanol
CID 66259192
2-[chloro(cyclobutyl)methyl]-5-ethylthiophene
CID 61082733
1-(5-fluoro-2-methylphenyl)-2-(oxolan-2-yl)ethanol
CID 62608272
1-(4-methyl-3-pyridinyl)-2-(oxolan-2-yl)ethanol
CID 66271830

Frequently Asked Questions

What is the IUPAC name of 1-(5-ethylthiophen-2-yl)-2-(oxolan-2-yl)ethanol?
The IUPAC name of 1-(5-ethylthiophen-2-yl)-2-(oxolan-2-yl)ethanol (CID 65149785) is 1-(5-ethylthiophen-2-yl)-2-(oxolan-2-yl)ethanol.
What is the SMILES notation for 1-(5-ethylthiophen-2-yl)-2-(oxolan-2-yl)ethanol?
The canonical SMILES for 1-(5-ethylthiophen-2-yl)-2-(oxolan-2-yl)ethanol is CCc1ccc(C(O)CC2CCCO2)s1.
What is the InChIKey of 1-(5-ethylthiophen-2-yl)-2-(oxolan-2-yl)ethanol?
The InChIKey is GMFRAGLITSWNAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18O2S/c1-2-10-5-6-12(15-10)11(13)8-9-4-3-7-14-9/h5-6,9,11,13H,2-4,7-8H2,1H3.
What are the key properties of 1-(5-ethylthiophen-2-yl)-2-(oxolan-2-yl)ethanol?
1-(5-ethylthiophen-2-yl)-2-(oxolan-2-yl)ethanol has a molecular weight of 226.34 g/mol, XLogP of 2.91, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-ethylthiophen-2-yl)-2-(oxolan-2-yl)ethanol is sourced from PubChem (CID 65149785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).