1-(2,3-dimethylphenyl)-2-(5-ethylthiophen-2-yl)ethanol

C16H20OS — CID 65148352

IUPAC1-(2,3-dimethylphenyl)-2-(5-ethylthiophen-2-yl)ethanol
SMILESCCc1ccc(CC(O)c2cccc(C)c2C)s1
InChIInChI=1S/C16H20OS/c1-4-13-8-9-14(18-13)10-16(17)15-7-5-6-11(2)12(15)3/h5-9,16-17H,4,10H2,1-3H3
InChIKeyNJYGHKJJFYJNLP-UHFFFAOYSA-N
MW260.40 g/mol
LogP4.20
Rot. Bonds4

About 1-(2,3-dimethylphenyl)-2-(5-ethylthiophen-2-yl)ethanol

1-(2,3-dimethylphenyl)-2-(5-ethylthiophen-2-yl)ethanol (PubChem CID 65148352) has the molecular formula C16H20OS and a molecular weight of 260.40 g/mol. Its IUPAC name is 1-(2,3-dimethylphenyl)-2-(5-ethylthiophen-2-yl)ethanol.

Molecular Properties

Compound Name1-(2,3-dimethylphenyl)-2-(5-ethylthiophen-2-yl)ethanol
PubChem CID65148352
Molecular FormulaC16H20OS
Molecular Weight260.40 g/mol
Exact Mass260.12
IUPAC Name1-(2,3-dimethylphenyl)-2-(5-ethylthiophen-2-yl)ethanol
SMILESCCc1ccc(CC(O)c2cccc(C)c2C)s1
InChIInChI=1S/C16H20OS/c1-4-13-8-9-14(18-13)10-16(17)15-7-5-6-11(2)12(15)3/h5-9,16-17H,4,10H2,1-3H3
InChIKeyNJYGHKJJFYJNLP-UHFFFAOYSA-N
XLogP4.20
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 ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(2,3-dimethylphenyl)-2-(5-ethylthiophen-2-yl)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

1-(2,3-dihydro-1,4-benzodioxin-5-yl)-2-(5-ethylthiophen-2-yl)ethanol
CID 105087755
3-(5-ethylthiophen-2-yl)-2-(2-methylphenyl)propan-1-ol
CID 79424431
1-(1,5-dimethylpyrazol-4-yl)-2-(5-ethylthiophen-2-yl)ethanol
CID 79583541
2-(5-ethylthiophen-2-yl)-1-(2-methylquinolin-4-yl)ethanol
CID 79233820
1-(3-ethoxyphenyl)-2-(5-ethylthiophen-2-yl)ethanol
CID 62606842
2-(5-ethylthiophen-2-yl)-1-isoquinolin-4-ylethanol
CID 104504624
1-(2,3-dimethylphenyl)-2-(5-ethyl-2-pyridinyl)ethanol
CID 79739903
1-(2,3-dimethylphenyl)-2-(1,3-thiazol-2-yl)ethanol
CID 79825091
1-(3-bromophenyl)-2-(5-ethylthiophen-2-yl)ethanol
CID 62606304
1-(2,3-dimethylphenyl)-2-methylsulfanylethanol
CID 62692978
1-(2,3-dimethylphenyl)octan-1-ol
CID 63900365
1-(3-bromo-4-methylphenyl)-2-(5-ethylthiophen-2-yl)ethanol
CID 115786511

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dimethylphenyl)-2-(5-ethylthiophen-2-yl)ethanol?
The IUPAC name of 1-(2,3-dimethylphenyl)-2-(5-ethylthiophen-2-yl)ethanol (CID 65148352) is 1-(2,3-dimethylphenyl)-2-(5-ethylthiophen-2-yl)ethanol.
What is the SMILES notation for 1-(2,3-dimethylphenyl)-2-(5-ethylthiophen-2-yl)ethanol?
The canonical SMILES for 1-(2,3-dimethylphenyl)-2-(5-ethylthiophen-2-yl)ethanol is CCc1ccc(CC(O)c2cccc(C)c2C)s1.
What is the InChIKey of 1-(2,3-dimethylphenyl)-2-(5-ethylthiophen-2-yl)ethanol?
The InChIKey is NJYGHKJJFYJNLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20OS/c1-4-13-8-9-14(18-13)10-16(17)15-7-5-6-11(2)12(15)3/h5-9,16-17H,4,10H2,1-3H3.
What are the key properties of 1-(2,3-dimethylphenyl)-2-(5-ethylthiophen-2-yl)ethanol?
1-(2,3-dimethylphenyl)-2-(5-ethylthiophen-2-yl)ethanol has a molecular weight of 260.40 g/mol, XLogP of 4.20, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dimethylphenyl)-2-(5-ethylthiophen-2-yl)ethanol is sourced from PubChem (CID 65148352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).