1-[3-methoxy-4-(2-thiophen-2-ylethoxy)phenyl]ethanol

C15H18O3S — CID 63774373

IUPAC1-[3-methoxy-4-(2-thiophen-2-ylethoxy)phenyl]ethanol
SMILESCOc1cc(C(C)O)ccc1OCCc1cccs1
InChIInChI=1S/C15H18O3S/c1-11(16)12-5-6-14(15(10-12)17-2)18-8-7-13-4-3-9-19-13/h3-6,9-11,16H,7-8H2,1-2H3
InChIKeyXXOYPLCJFPXPSO-UHFFFAOYSA-N
MW278.37 g/mol
LogP3.43
Rot. Bonds6

About 1-[3-methoxy-4-(2-thiophen-2-ylethoxy)phenyl]ethanol

1-[3-methoxy-4-(2-thiophen-2-ylethoxy)phenyl]ethanol (PubChem CID 63774373) has the molecular formula C15H18O3S and a molecular weight of 278.37 g/mol. Its IUPAC name is 1-[3-methoxy-4-(2-thiophen-2-ylethoxy)phenyl]ethanol.

Molecular Properties

Compound Name1-[3-methoxy-4-(2-thiophen-2-ylethoxy)phenyl]ethanol
PubChem CID63774373
Molecular FormulaC15H18O3S
Molecular Weight278.37 g/mol
Exact Mass278.10
IUPAC Name1-[3-methoxy-4-(2-thiophen-2-ylethoxy)phenyl]ethanol
SMILESCOc1cc(C(C)O)ccc1OCCc1cccs1
InChIInChI=1S/C15H18O3S/c1-11(16)12-5-6-14(15(10-12)17-2)18-8-7-13-4-3-9-19-13/h3-6,9-11,16H,7-8H2,1-2H3
InChIKeyXXOYPLCJFPXPSO-UHFFFAOYSA-N
XLogP3.43
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.37
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[3-methoxy-4-(2-thiophen-2-ylethoxy)phenyl]ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(1R)-1-[3-methoxy-4-(thiophen-2-ylmethoxy)phenyl]ethanol
CID 63364423
(1S)-1-[4-methoxy-2-(2-thiophen-2-ylethoxy)phenyl]ethanol
CID 82002105
(1S)-1-[2-(2-thiophen-2-ylethoxy)phenyl]ethanol
CID 78951125
(1S)-1-(4-butoxy-3-methoxyphenyl)ethanol
CID 63364662
1-(3,4-dimethoxyphenyl)-2-thiophen-2-ylethanol
CID 55136258
3-methoxy-4-(2-thiophen-2-ylethoxy)benzonitrile
CID 55235730
4-[4-[(1S)-1-hydroxyethyl]-2-methoxyphenoxy]butan-1-ol
CID 55188992
N'-hydroxy-3-methoxy-4-(2-thiophen-2-ylethoxy)benzenecarboximidamide
CID 76975002
(1R)-1-[3-methoxy-4-(methoxymethoxy)phenyl]ethanol
CID 65364454
4-[4-[(1R)-1-hydroxyethyl]-2-methoxyphenoxy]butanenitrile
CID 55189697
4-[4-[(1S)-1-hydroxyethyl]-2-methoxyphenoxy]-2-methylbutan-2-ol
CID 79355074
4-[4-(1-hydroxyethyl)-2-methoxyphenoxy]butanenitrile
CID 43503833

Frequently Asked Questions

What is the IUPAC name of 1-[3-methoxy-4-(2-thiophen-2-ylethoxy)phenyl]ethanol?
The IUPAC name of 1-[3-methoxy-4-(2-thiophen-2-ylethoxy)phenyl]ethanol (CID 63774373) is 1-[3-methoxy-4-(2-thiophen-2-ylethoxy)phenyl]ethanol.
What is the SMILES notation for 1-[3-methoxy-4-(2-thiophen-2-ylethoxy)phenyl]ethanol?
The canonical SMILES for 1-[3-methoxy-4-(2-thiophen-2-ylethoxy)phenyl]ethanol is COc1cc(C(C)O)ccc1OCCc1cccs1.
What is the InChIKey of 1-[3-methoxy-4-(2-thiophen-2-ylethoxy)phenyl]ethanol?
The InChIKey is XXOYPLCJFPXPSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18O3S/c1-11(16)12-5-6-14(15(10-12)17-2)18-8-7-13-4-3-9-19-13/h3-6,9-11,16H,7-8H2,1-2H3.
What are the key properties of 1-[3-methoxy-4-(2-thiophen-2-ylethoxy)phenyl]ethanol?
1-[3-methoxy-4-(2-thiophen-2-ylethoxy)phenyl]ethanol has a molecular weight of 278.37 g/mol, XLogP of 3.43, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-methoxy-4-(2-thiophen-2-ylethoxy)phenyl]ethanol is sourced from PubChem (CID 63774373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).