1-(5-methylthiophen-3-yl)-1-thiophen-2-ylethanol

C11H12OS2 — CID 65099550

IUPAC1-(5-methylthiophen-3-yl)-1-thiophen-2-ylethanol
SMILESCc1cc(C(C)(O)c2cccs2)cs1
InChIInChI=1S/C11H12OS2/c1-8-6-9(7-14-8)11(2,12)10-4-3-5-13-10/h3-7,12H,1-2H3
InChIKeyRFFVWHHCNXJHDS-UHFFFAOYSA-N
MW224.35 g/mol
LogP3.37
Rot. Bonds2

About 1-(5-methylthiophen-3-yl)-1-thiophen-2-ylethanol

1-(5-methylthiophen-3-yl)-1-thiophen-2-ylethanol (PubChem CID 65099550) has the molecular formula C11H12OS2 and a molecular weight of 224.35 g/mol. Its IUPAC name is 1-(5-methylthiophen-3-yl)-1-thiophen-2-ylethanol.

Molecular Properties

Compound Name1-(5-methylthiophen-3-yl)-1-thiophen-2-ylethanol
PubChem CID65099550
Molecular FormulaC11H12OS2
Molecular Weight224.35 g/mol
Exact Mass224.03
IUPAC Name1-(5-methylthiophen-3-yl)-1-thiophen-2-ylethanol
SMILESCc1cc(C(C)(O)c2cccs2)cs1
InChIInChI=1S/C11H12OS2/c1-8-6-9(7-14-8)11(2,12)10-4-3-5-13-10/h3-7,12H,1-2H3
InChIKeyRFFVWHHCNXJHDS-UHFFFAOYSA-N
XLogP3.37
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3,5-dimethylphenyl)-1-thiophen-2-ylethanol
CID 63220765
(1R)-1-phenyl-1-thiophen-2-ylethanol
CID 674763
1-(3,4-dichlorophenyl)-1-thiophen-2-ylethanol
CID 63220767
1-(furan-3-yl)-1-thiophen-2-ylethanol
CID 63947725
1-[4-fluoro-3-(trifluoromethyl)phenyl]-1-thiophen-2-ylethanol
CID 107287122
1-quinolin-3-yl-1-thiophen-2-ylethanol
CID 55163309
1-(4-butylphenyl)-1-thiophen-2-ylethanol
CID 58735357
1-(2-fluoro-6-methoxyphenyl)-1-(5-methylthiophen-3-yl)ethanol
CID 113389290
1-(1-ethylpyrazol-4-yl)-1-thiophen-2-ylethanol
CID 63220679
4-[2,2-dimethyl-1,1-bis(5-methylthiophen-3-yl)propyl]-2-methylthiophene
CID 10832401
1-hydroxy-1,1-dithiophen-2-ylpropan-2-one
CID 23553455
1-(7-methyl-1-benzofuran-2-yl)-1-thiophen-2-ylethanol
CID 114723213

Frequently Asked Questions

What is the IUPAC name of 1-(5-methylthiophen-3-yl)-1-thiophen-2-ylethanol?
The IUPAC name of 1-(5-methylthiophen-3-yl)-1-thiophen-2-ylethanol (CID 65099550) is 1-(5-methylthiophen-3-yl)-1-thiophen-2-ylethanol.
What is the SMILES notation for 1-(5-methylthiophen-3-yl)-1-thiophen-2-ylethanol?
The canonical SMILES for 1-(5-methylthiophen-3-yl)-1-thiophen-2-ylethanol is Cc1cc(C(C)(O)c2cccs2)cs1.
What is the InChIKey of 1-(5-methylthiophen-3-yl)-1-thiophen-2-ylethanol?
The InChIKey is RFFVWHHCNXJHDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12OS2/c1-8-6-9(7-14-8)11(2,12)10-4-3-5-13-10/h3-7,12H,1-2H3.
What are the key properties of 1-(5-methylthiophen-3-yl)-1-thiophen-2-ylethanol?
1-(5-methylthiophen-3-yl)-1-thiophen-2-ylethanol has a molecular weight of 224.35 g/mol, XLogP of 3.37, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-methylthiophen-3-yl)-1-thiophen-2-ylethanol is sourced from PubChem (CID 65099550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).