1-(2,5-dimethylthiophen-3-yl)-2-(2-methoxyphenyl)ethanol

C15H18O2S — CID 61087046

IUPAC1-(2,5-dimethylthiophen-3-yl)-2-(2-methoxyphenyl)ethanol
SMILESCOc1ccccc1CC(O)c1cc(C)sc1C
InChIInChI=1S/C15H18O2S/c1-10-8-13(11(2)18-10)14(16)9-12-6-4-5-7-15(12)17-3/h4-8,14,16H,9H2,1-3H3
InChIKeyLTNPWZJZUVFGIR-UHFFFAOYSA-N
MW262.37 g/mol
LogP3.65
Rot. Bonds4

About 1-(2,5-dimethylthiophen-3-yl)-2-(2-methoxyphenyl)ethanol

1-(2,5-dimethylthiophen-3-yl)-2-(2-methoxyphenyl)ethanol (PubChem CID 61087046) has the molecular formula C15H18O2S and a molecular weight of 262.37 g/mol. Its IUPAC name is 1-(2,5-dimethylthiophen-3-yl)-2-(2-methoxyphenyl)ethanol.

Molecular Properties

Compound Name1-(2,5-dimethylthiophen-3-yl)-2-(2-methoxyphenyl)ethanol
PubChem CID61087046
Molecular FormulaC15H18O2S
Molecular Weight262.37 g/mol
Exact Mass262.10
IUPAC Name1-(2,5-dimethylthiophen-3-yl)-2-(2-methoxyphenyl)ethanol
SMILESCOc1ccccc1CC(O)c1cc(C)sc1C
InChIInChI=1S/C15H18O2S/c1-10-8-13(11(2)18-10)14(16)9-12-6-4-5-7-15(12)17-3/h4-8,14,16H,9H2,1-3H3
InChIKeyLTNPWZJZUVFGIR-UHFFFAOYSA-N
XLogP3.65
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.37
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3,4-dimethoxyphenyl)-1-(2,5-dimethylthiophen-3-yl)ethanol
CID 61088345
1-(4-fluoro-2-methylphenyl)-2-(2-methoxyphenyl)ethanol
CID 62790475
1-(5-bromo-2-methoxy-4-methylphenyl)-2-(2-methoxyphenyl)ethanol
CID 65434708
1-(2,6-dimethoxyphenyl)-2-(2-methoxyphenyl)ethanol
CID 63018829
2-(2-methoxyphenyl)-1-(4-methyl-3-pyridinyl)ethanol
CID 66272470
1-(2-methoxy-3,4-dimethylphenyl)-2-(2-methoxyphenyl)ethanol
CID 103433092
1-(5-chloro-2-fluorophenyl)-2-(2-methoxyphenyl)ethanol
CID 55151769
(1S)-1-(2,5-dimethylthiophen-3-yl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]ethanol
CID 92600875
3-[chloro-(2,6-dimethoxyphenyl)methyl]-2,5-dimethylthiophene
CID 61084593
2-(2-methoxyphenyl)-1-thiophen-2-ylethanol
CID 61087312
(2R)-1-(2-methoxyphenyl)propan-2-ol
CID 6951555
2-[2-(hydroxymethyl)phenyl]-1-(2-methoxyphenyl)ethanol
CID 102015925

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-dimethylthiophen-3-yl)-2-(2-methoxyphenyl)ethanol?
The IUPAC name of 1-(2,5-dimethylthiophen-3-yl)-2-(2-methoxyphenyl)ethanol (CID 61087046) is 1-(2,5-dimethylthiophen-3-yl)-2-(2-methoxyphenyl)ethanol.
What is the SMILES notation for 1-(2,5-dimethylthiophen-3-yl)-2-(2-methoxyphenyl)ethanol?
The canonical SMILES for 1-(2,5-dimethylthiophen-3-yl)-2-(2-methoxyphenyl)ethanol is COc1ccccc1CC(O)c1cc(C)sc1C.
What is the InChIKey of 1-(2,5-dimethylthiophen-3-yl)-2-(2-methoxyphenyl)ethanol?
The InChIKey is LTNPWZJZUVFGIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18O2S/c1-10-8-13(11(2)18-10)14(16)9-12-6-4-5-7-15(12)17-3/h4-8,14,16H,9H2,1-3H3.
What are the key properties of 1-(2,5-dimethylthiophen-3-yl)-2-(2-methoxyphenyl)ethanol?
1-(2,5-dimethylthiophen-3-yl)-2-(2-methoxyphenyl)ethanol has a molecular weight of 262.37 g/mol, XLogP of 3.65, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-dimethylthiophen-3-yl)-2-(2-methoxyphenyl)ethanol is sourced from PubChem (CID 61087046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).