1-(5-chlorothiophen-2-yl)-2-(3,4-dimethylphenyl)ethanol

C14H15ClOS — CID 62537661

IUPAC1-(5-chlorothiophen-2-yl)-2-(3,4-dimethylphenyl)ethanol
SMILESCc1ccc(CC(O)c2ccc(Cl)s2)cc1C
InChIInChI=1S/C14H15ClOS/c1-9-3-4-11(7-10(9)2)8-12(16)13-5-6-14(15)17-13/h3-7,12,16H,8H2,1-2H3
InChIKeySLFQVACYOHPMBT-UHFFFAOYSA-N
MW266.79 g/mol
LogP4.29
Rot. Bonds3

About 1-(5-chlorothiophen-2-yl)-2-(3,4-dimethylphenyl)ethanol

1-(5-chlorothiophen-2-yl)-2-(3,4-dimethylphenyl)ethanol (PubChem CID 62537661) has the molecular formula C14H15ClOS and a molecular weight of 266.79 g/mol. Its IUPAC name is 1-(5-chlorothiophen-2-yl)-2-(3,4-dimethylphenyl)ethanol.

Molecular Properties

Compound Name1-(5-chlorothiophen-2-yl)-2-(3,4-dimethylphenyl)ethanol
PubChem CID62537661
Molecular FormulaC14H15ClOS
Molecular Weight266.79 g/mol
Exact Mass266.05
IUPAC Name1-(5-chlorothiophen-2-yl)-2-(3,4-dimethylphenyl)ethanol
SMILESCc1ccc(CC(O)c2ccc(Cl)s2)cc1C
InChIInChI=1S/C14H15ClOS/c1-9-3-4-11(7-10(9)2)8-12(16)13-5-6-14(15)17-13/h3-7,12,16H,8H2,1-2H3
InChIKeySLFQVACYOHPMBT-UHFFFAOYSA-N
XLogP4.29
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.79
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(5-chlorothiophen-2-yl)-2-(3,4-dimethylphenyl)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-(5-chlorothiophen-2-yl)-3-(3,4-dimethylphenyl)propan-2-ol
CID 62899782
1-(5-bromo-4-chlorothiophen-2-yl)-2-(3,4-dimethylphenyl)ethanol
CID 80533300
1-(5-chlorothiophen-2-yl)-2-(4-propan-2-ylphenyl)ethanol
CID 65150022
1-(5-chlorothiophen-2-yl)-3-(3,4-dimethylphenyl)propan-2-amine
CID 62899977
1-(2-chloro-4,5-dimethylphenyl)-2-(3,4-dimethylphenyl)ethanol
CID 115484564
2-[2-(5-chlorothiophen-2-yl)-2-hydroxyethyl]-1-(3,4-dimethylphenyl)guanidine
CID 111822256
(1S)-2-chloro-1-(5-chlorothiophen-2-yl)ethanol
CID 83001660
2-(5-chloro-2-methoxyphenyl)-1-(5-chlorothiophen-2-yl)ethanol
CID 65150275
1-(5-chlorothiophen-2-yl)-2-(methylamino)ethanol
CID 79002149
2-(3,4-dimethylphenyl)-1-(4-iodophenyl)ethanol
CID 63519463
1-(5-chlorothiophen-2-yl)-3-(2-methylphenyl)propan-1-ol
CID 105119687
1-(5-chloro-4-methylthiophen-2-yl)-2-(4-chlorophenyl)ethanol
CID 102764589

Frequently Asked Questions

What is the IUPAC name of 1-(5-chlorothiophen-2-yl)-2-(3,4-dimethylphenyl)ethanol?
The IUPAC name of 1-(5-chlorothiophen-2-yl)-2-(3,4-dimethylphenyl)ethanol (CID 62537661) is 1-(5-chlorothiophen-2-yl)-2-(3,4-dimethylphenyl)ethanol.
What is the SMILES notation for 1-(5-chlorothiophen-2-yl)-2-(3,4-dimethylphenyl)ethanol?
The canonical SMILES for 1-(5-chlorothiophen-2-yl)-2-(3,4-dimethylphenyl)ethanol is Cc1ccc(CC(O)c2ccc(Cl)s2)cc1C.
What is the InChIKey of 1-(5-chlorothiophen-2-yl)-2-(3,4-dimethylphenyl)ethanol?
The InChIKey is SLFQVACYOHPMBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClOS/c1-9-3-4-11(7-10(9)2)8-12(16)13-5-6-14(15)17-13/h3-7,12,16H,8H2,1-2H3.
What are the key properties of 1-(5-chlorothiophen-2-yl)-2-(3,4-dimethylphenyl)ethanol?
1-(5-chlorothiophen-2-yl)-2-(3,4-dimethylphenyl)ethanol has a molecular weight of 266.79 g/mol, XLogP of 4.29, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-chlorothiophen-2-yl)-2-(3,4-dimethylphenyl)ethanol is sourced from PubChem (CID 62537661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).