1-(4-ethylphenyl)-2-(3-methylthiophen-2-yl)propan-2-ol

C16H20OS — CID 63990522

IUPAC1-(4-ethylphenyl)-2-(3-methylthiophen-2-yl)propan-2-ol
SMILESCCc1ccc(CC(C)(O)c2sccc2C)cc1
InChIInChI=1S/C16H20OS/c1-4-13-5-7-14(8-6-13)11-16(3,17)15-12(2)9-10-18-15/h5-10,17H,4,11H2,1-3H3
InChIKeyNZKOYUIXZIJECO-UHFFFAOYSA-N
MW260.40 g/mol
LogP4.07
Rot. Bonds4

About 1-(4-ethylphenyl)-2-(3-methylthiophen-2-yl)propan-2-ol

1-(4-ethylphenyl)-2-(3-methylthiophen-2-yl)propan-2-ol (PubChem CID 63990522) has the molecular formula C16H20OS and a molecular weight of 260.40 g/mol. Its IUPAC name is 1-(4-ethylphenyl)-2-(3-methylthiophen-2-yl)propan-2-ol.

Molecular Properties

Compound Name1-(4-ethylphenyl)-2-(3-methylthiophen-2-yl)propan-2-ol
PubChem CID63990522
Molecular FormulaC16H20OS
Molecular Weight260.40 g/mol
Exact Mass260.12
IUPAC Name1-(4-ethylphenyl)-2-(3-methylthiophen-2-yl)propan-2-ol
SMILESCCc1ccc(CC(C)(O)c2sccc2C)cc1
InChIInChI=1S/C16H20OS/c1-4-13-5-7-14(8-6-13)11-16(3,17)15-12(2)9-10-18-15/h5-10,17H,4,11H2,1-3H3
InChIKeyNZKOYUIXZIJECO-UHFFFAOYSA-N
XLogP4.07
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.40
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(4-ethylphenyl)-2-(3-methylthiophen-2-yl)propan-2-ol 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

2-(3-methylthiophen-2-yl)-1-thiophen-3-ylpropan-2-ol
CID 65148928
1-(3-fluoro-4-methoxyphenyl)-2-(3-methylthiophen-2-yl)propan-2-ol
CID 65149465
1-(2,6-difluorophenyl)-2-(3-methylthiophen-2-yl)propan-2-ol
CID 114931026
3-hydroxy-3-(3-methylthiophen-2-yl)butanenitrile
CID 79118234
2-(3-methylthiophen-2-yl)pent-4-en-2-ol
CID 79734594
2-(3-chlorothiophen-2-yl)-1-phenylpropan-2-ol
CID 107358997
(2S)-2-(3-methylthiophen-2-yl)butan-2-amine
CID 130055008
2-[1-(4-fluorophenyl)-2-hydroxypropan-2-yl]thiophene-3-carboxylic acid
CID 107432653
1-(5-bromo-2-methoxyphenyl)-2-(3-methylthiophen-2-yl)propan-2-ol
CID 63990515
1-(3-methylthiophen-2-yl)-1-phenylpropan-1-ol
CID 79990862
2-(1-bromo-2-methylpropan-2-yl)-3-methylthiophene
CID 83692596
1-(5-fluoro-2-methylphenyl)-1-(3-methylthiophen-2-yl)ethanol
CID 63991310

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethylphenyl)-2-(3-methylthiophen-2-yl)propan-2-ol?
The IUPAC name of 1-(4-ethylphenyl)-2-(3-methylthiophen-2-yl)propan-2-ol (CID 63990522) is 1-(4-ethylphenyl)-2-(3-methylthiophen-2-yl)propan-2-ol.
What is the SMILES notation for 1-(4-ethylphenyl)-2-(3-methylthiophen-2-yl)propan-2-ol?
The canonical SMILES for 1-(4-ethylphenyl)-2-(3-methylthiophen-2-yl)propan-2-ol is CCc1ccc(CC(C)(O)c2sccc2C)cc1.
What is the InChIKey of 1-(4-ethylphenyl)-2-(3-methylthiophen-2-yl)propan-2-ol?
The InChIKey is NZKOYUIXZIJECO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20OS/c1-4-13-5-7-14(8-6-13)11-16(3,17)15-12(2)9-10-18-15/h5-10,17H,4,11H2,1-3H3.
What are the key properties of 1-(4-ethylphenyl)-2-(3-methylthiophen-2-yl)propan-2-ol?
1-(4-ethylphenyl)-2-(3-methylthiophen-2-yl)propan-2-ol has a molecular weight of 260.40 g/mol, XLogP of 4.07, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethylphenyl)-2-(3-methylthiophen-2-yl)propan-2-ol is sourced from PubChem (CID 63990522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).