2-(2,5-dimethylphenyl)-1-thiophen-2-ylethanol

C14H16OS — CID 61481652

IUPAC2-(2,5-dimethylphenyl)-1-thiophen-2-ylethanol
SMILESCc1ccc(C)c(CC(O)c2cccs2)c1
InChIInChI=1S/C14H16OS/c1-10-5-6-11(2)12(8-10)9-13(15)14-4-3-7-16-14/h3-8,13,15H,9H2,1-2H3
InChIKeyKRVLFRUTTBSTQP-UHFFFAOYSA-N
MW232.35 g/mol
LogP3.64
Rot. Bonds3

About 2-(2,5-dimethylphenyl)-1-thiophen-2-ylethanol

2-(2,5-dimethylphenyl)-1-thiophen-2-ylethanol (PubChem CID 61481652) has the molecular formula C14H16OS and a molecular weight of 232.35 g/mol. Its IUPAC name is 2-(2,5-dimethylphenyl)-1-thiophen-2-ylethanol.

Molecular Properties

Compound Name2-(2,5-dimethylphenyl)-1-thiophen-2-ylethanol
PubChem CID61481652
Molecular FormulaC14H16OS
Molecular Weight232.35 g/mol
Exact Mass232.09
IUPAC Name2-(2,5-dimethylphenyl)-1-thiophen-2-ylethanol
SMILESCc1ccc(C)c(CC(O)c2cccs2)c1
InChIInChI=1S/C14H16OS/c1-10-5-6-11(2)12(8-10)9-13(15)14-4-3-7-16-14/h3-8,13,15H,9H2,1-2H3
InChIKeyKRVLFRUTTBSTQP-UHFFFAOYSA-N
XLogP3.64
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.35
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,5-dimethylphenyl)-N-ethyl-1-thiophen-2-ylethanamine
CID 61481816
2-(2,5-dimethylphenyl)-1-(3-ethylthiophen-2-yl)ethanol
CID 79976014
2-(2,5-dimethylphenyl)-1-(4-methylphenyl)ethanol
CID 61481687
2-(2,5-dimethylphenyl)-1-naphthalen-1-ylethanol
CID 63411264
2-[4-chloro-5-(2,5-dimethylphenyl)pentyl]thiophene
CID 63544769
(2R)-1-(2,5-dimethylphenyl)butan-2-ol
CID 94208295
2-(2-bromophenyl)-1-thiophen-2-ylethanol
CID 60798008
2-(2-methoxyphenyl)-1-thiophen-2-ylethanol
CID 61087312
2-(2,5-dimethylphenyl)-1-(2,4,6-trifluorophenyl)ethanol
CID 62538036
1-(4-bromothiophen-3-yl)-2-(2,5-dimethylphenyl)ethanol
CID 115820172
1-(2,5-dichlorothiophen-3-yl)-2-(2,5-dimethylphenyl)ethanol
CID 63427104
2-(2,5-dimethylphenyl)-1-(4-fluoro-3-methylphenyl)ethanol
CID 61482044

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylphenyl)-1-thiophen-2-ylethanol?
The IUPAC name of 2-(2,5-dimethylphenyl)-1-thiophen-2-ylethanol (CID 61481652) is 2-(2,5-dimethylphenyl)-1-thiophen-2-ylethanol.
What is the SMILES notation for 2-(2,5-dimethylphenyl)-1-thiophen-2-ylethanol?
The canonical SMILES for 2-(2,5-dimethylphenyl)-1-thiophen-2-ylethanol is Cc1ccc(C)c(CC(O)c2cccs2)c1.
What is the InChIKey of 2-(2,5-dimethylphenyl)-1-thiophen-2-ylethanol?
The InChIKey is KRVLFRUTTBSTQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16OS/c1-10-5-6-11(2)12(8-10)9-13(15)14-4-3-7-16-14/h3-8,13,15H,9H2,1-2H3.
What are the key properties of 2-(2,5-dimethylphenyl)-1-thiophen-2-ylethanol?
2-(2,5-dimethylphenyl)-1-thiophen-2-ylethanol has a molecular weight of 232.35 g/mol, XLogP of 3.64, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethylphenyl)-1-thiophen-2-ylethanol is sourced from PubChem (CID 61481652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).