1-(4,5-dimethylthiophen-2-yl)-2-(4-methoxyphenyl)ethanol

C15H18O2S — CID 65238266

IUPAC1-(4,5-dimethylthiophen-2-yl)-2-(4-methoxyphenyl)ethanol
SMILESCOc1ccc(CC(O)c2cc(C)c(C)s2)cc1
InChIInChI=1S/C15H18O2S/c1-10-8-15(18-11(10)2)14(16)9-12-4-6-13(17-3)7-5-12/h4-8,14,16H,9H2,1-3H3
InChIKeyVCFAYBFVXPMURQ-UHFFFAOYSA-N
MW262.37 g/mol
LogP3.65
Rot. Bonds4

About 1-(4,5-dimethylthiophen-2-yl)-2-(4-methoxyphenyl)ethanol

1-(4,5-dimethylthiophen-2-yl)-2-(4-methoxyphenyl)ethanol (PubChem CID 65238266) has the molecular formula C15H18O2S and a molecular weight of 262.37 g/mol. Its IUPAC name is 1-(4,5-dimethylthiophen-2-yl)-2-(4-methoxyphenyl)ethanol.

Molecular Properties

Compound Name1-(4,5-dimethylthiophen-2-yl)-2-(4-methoxyphenyl)ethanol
PubChem CID65238266
Molecular FormulaC15H18O2S
Molecular Weight262.37 g/mol
Exact Mass262.10
IUPAC Name1-(4,5-dimethylthiophen-2-yl)-2-(4-methoxyphenyl)ethanol
SMILESCOc1ccc(CC(O)c2cc(C)c(C)s2)cc1
InChIInChI=1S/C15H18O2S/c1-10-8-15(18-11(10)2)14(16)9-12-4-6-13(17-3)7-5-12/h4-8,14,16H,9H2,1-3H3
InChIKeyVCFAYBFVXPMURQ-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

1-(4,5-dimethylthiophen-2-yl)-2-[4-(trifluoromethoxy)phenyl]ethanol
CID 115787194
1-(4,5-dimethylthiophen-2-yl)-N-ethyl-2-(4-methoxyphenyl)ethanamine
CID 65239260
2-(4-methoxyphenyl)-1-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)ethanol
CID 63016751
1-(5-chloro-4-methylthiophen-2-yl)-2-(4-methoxyphenyl)ethanamine
CID 102763454
1-(2,5-dichlorothiophen-3-yl)-2-(4-methoxyphenyl)ethanol
CID 61081417
1-(4,5-dimethylthiophen-2-yl)-2-(2-methyl-1,3-thiazol-4-yl)ethanol
CID 115812072
1-(3,5-dimethylphenyl)-3-(4-methoxyphenyl)propan-2-ol
CID 61375136
1-(2-fluoro-4,6-dimethylphenyl)-2-(4-methoxyphenyl)ethanol
CID 106881014
2-(2,4-dichlorophenyl)-1-(4,5-dimethylthiophen-2-yl)ethanol
CID 115785074
1-(4,5-dimethylthiophen-2-yl)-2-(3-methyl-2-pyridinyl)ethanol
CID 66459897
1-(2,5-dimethylthiophen-3-yl)-3-(4-methoxyphenyl)propan-1-ol
CID 61086865
1-(5-bromo-2-methoxy-4-methylphenyl)-2-(4-methoxyphenyl)ethanol
CID 65434522

Frequently Asked Questions

What is the IUPAC name of 1-(4,5-dimethylthiophen-2-yl)-2-(4-methoxyphenyl)ethanol?
The IUPAC name of 1-(4,5-dimethylthiophen-2-yl)-2-(4-methoxyphenyl)ethanol (CID 65238266) is 1-(4,5-dimethylthiophen-2-yl)-2-(4-methoxyphenyl)ethanol.
What is the SMILES notation for 1-(4,5-dimethylthiophen-2-yl)-2-(4-methoxyphenyl)ethanol?
The canonical SMILES for 1-(4,5-dimethylthiophen-2-yl)-2-(4-methoxyphenyl)ethanol is COc1ccc(CC(O)c2cc(C)c(C)s2)cc1.
What is the InChIKey of 1-(4,5-dimethylthiophen-2-yl)-2-(4-methoxyphenyl)ethanol?
The InChIKey is VCFAYBFVXPMURQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18O2S/c1-10-8-15(18-11(10)2)14(16)9-12-4-6-13(17-3)7-5-12/h4-8,14,16H,9H2,1-3H3.
What are the key properties of 1-(4,5-dimethylthiophen-2-yl)-2-(4-methoxyphenyl)ethanol?
1-(4,5-dimethylthiophen-2-yl)-2-(4-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-(4,5-dimethylthiophen-2-yl)-2-(4-methoxyphenyl)ethanol is sourced from PubChem (CID 65238266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).