2-(2,5-dimethylthiophen-3-yl)ethanol

C8H12OS — CID 13144702

IUPAC2-(2,5-dimethylthiophen-3-yl)ethanol
SMILESCc1cc(CCO)c(C)s1
InChIInChI=1S/C8H12OS/c1-6-5-8(3-4-9)7(2)10-6/h5,9H,3-4H2,1-2H3
InChIKeyUOSGVMNPXNASFC-UHFFFAOYSA-N
MW156.25 g/mol
LogP1.90
Rot. Bonds2

About 2-(2,5-dimethylthiophen-3-yl)ethanol

2-(2,5-dimethylthiophen-3-yl)ethanol (PubChem CID 13144702) has the molecular formula C8H12OS and a molecular weight of 156.25 g/mol. Its IUPAC name is 2-(2,5-dimethylthiophen-3-yl)ethanol.

Molecular Properties

Compound Name2-(2,5-dimethylthiophen-3-yl)ethanol
PubChem CID13144702
Molecular FormulaC8H12OS
Molecular Weight156.25 g/mol
Exact Mass156.06
IUPAC Name2-(2,5-dimethylthiophen-3-yl)ethanol
SMILESCc1cc(CCO)c(C)s1
InChIInChI=1S/C8H12OS/c1-6-5-8(3-4-9)7(2)10-6/h5,9H,3-4H2,1-2H3
InChIKeyUOSGVMNPXNASFC-UHFFFAOYSA-N
XLogP1.90
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.25
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylthiophen-3-yl)ethanol?
The IUPAC name of 2-(2,5-dimethylthiophen-3-yl)ethanol (CID 13144702) is 2-(2,5-dimethylthiophen-3-yl)ethanol.
What is the SMILES notation for 2-(2,5-dimethylthiophen-3-yl)ethanol?
The canonical SMILES for 2-(2,5-dimethylthiophen-3-yl)ethanol is Cc1cc(CCO)c(C)s1.
What is the InChIKey of 2-(2,5-dimethylthiophen-3-yl)ethanol?
The InChIKey is UOSGVMNPXNASFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12OS/c1-6-5-8(3-4-9)7(2)10-6/h5,9H,3-4H2,1-2H3.
What are the key properties of 2-(2,5-dimethylthiophen-3-yl)ethanol?
2-(2,5-dimethylthiophen-3-yl)ethanol has a molecular weight of 156.25 g/mol, XLogP of 1.90, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethylthiophen-3-yl)ethanol is sourced from PubChem (CID 13144702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).