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

C12H18OS — CID 64986887

IUPAC1-cyclobutyl-2-(5-ethylthiophen-2-yl)ethanol
SMILESCCc1ccc(CC(O)C2CCC2)s1
InChIInChI=1S/C12H18OS/c1-2-10-6-7-11(14-10)8-12(13)9-4-3-5-9/h6-7,9,12-13H,2-5,8H2,1H3
InChIKeyNTJUKXNOWLJPEI-UHFFFAOYSA-N
MW210.34 g/mol
LogP3.01
Rot. Bonds4

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

1-cyclobutyl-2-(5-ethylthiophen-2-yl)ethanol (PubChem CID 64986887) has the molecular formula C12H18OS and a molecular weight of 210.34 g/mol. Its IUPAC name is 1-cyclobutyl-2-(5-ethylthiophen-2-yl)ethanol.

Molecular Properties

Compound Name1-cyclobutyl-2-(5-ethylthiophen-2-yl)ethanol
PubChem CID64986887
Molecular FormulaC12H18OS
Molecular Weight210.34 g/mol
Exact Mass210.11
IUPAC Name1-cyclobutyl-2-(5-ethylthiophen-2-yl)ethanol
SMILESCCc1ccc(CC(O)C2CCC2)s1
InChIInChI=1S/C12H18OS/c1-2-10-6-7-11(14-10)8-12(13)9-4-3-5-9/h6-7,9,12-13H,2-5,8H2,1H3
InChIKeyNTJUKXNOWLJPEI-UHFFFAOYSA-N
XLogP3.01
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.34
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-cyclobutyl-2-(5-ethylthiophen-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

2-(5-ethylthiophen-2-yl)-1-pyrrolidin-2-ylethanol
CID 106639830
1-(2,2-dimethylcyclohexyl)-2-(5-ethylthiophen-2-yl)ethanol
CID 107192144
1-cyclobutyl-2-(4-ethylphenyl)ethanol
CID 64986891
N-[3-(5-ethylthiophen-2-yl)-2-methylpropyl]cyclobutanamine
CID 114899203
1-cyclopentyl-3-(5-ethylthiophen-2-yl)propan-2-amine
CID 115842609
1-(3-ethyl-1,4-dithian-2-yl)-2-(5-ethylthiophen-2-yl)ethanol
CID 115386540
2-[chloro(cyclobutyl)methyl]-5-ethylthiophene
CID 61082733
1-cyclobutyl-2-(5-ethylthiophen-2-yl)ethanone
CID 64982251
2-cyclopentyl-3-(5-ethylthiophen-2-yl)-N-propylpropan-1-amine
CID 112569956
1-cyclohexylsulfanyl-3-(5-ethylthiophen-2-yl)propan-2-ol
CID 65139689
N-[1-cyclohexyl-2-(5-ethylthiophen-2-yl)ethyl]propan-1-amine
CID 63413397
2-(5-bromothiophen-2-yl)-1-(4-propylcyclohexyl)ethanol
CID 65423327

Frequently Asked Questions

What is the IUPAC name of 1-cyclobutyl-2-(5-ethylthiophen-2-yl)ethanol?
The IUPAC name of 1-cyclobutyl-2-(5-ethylthiophen-2-yl)ethanol (CID 64986887) is 1-cyclobutyl-2-(5-ethylthiophen-2-yl)ethanol.
What is the SMILES notation for 1-cyclobutyl-2-(5-ethylthiophen-2-yl)ethanol?
The canonical SMILES for 1-cyclobutyl-2-(5-ethylthiophen-2-yl)ethanol is CCc1ccc(CC(O)C2CCC2)s1.
What is the InChIKey of 1-cyclobutyl-2-(5-ethylthiophen-2-yl)ethanol?
The InChIKey is NTJUKXNOWLJPEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18OS/c1-2-10-6-7-11(14-10)8-12(13)9-4-3-5-9/h6-7,9,12-13H,2-5,8H2,1H3.
What are the key properties of 1-cyclobutyl-2-(5-ethylthiophen-2-yl)ethanol?
1-cyclobutyl-2-(5-ethylthiophen-2-yl)ethanol has a molecular weight of 210.34 g/mol, XLogP of 3.01, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutyl-2-(5-ethylthiophen-2-yl)ethanol is sourced from PubChem (CID 64986887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).