1-(2,3-dimethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanol

C14H17NOS — CID 62797386

IUPAC1-(2,3-dimethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanol
SMILESCc1csc(CC(O)c2cccc(C)c2C)n1
InChIInChI=1S/C14H17NOS/c1-9-5-4-6-12(11(9)3)13(16)7-14-15-10(2)8-17-14/h4-6,8,13,16H,7H2,1-3H3
InChIKeyRTQMSKDVDPKZSM-UHFFFAOYSA-N
MW247.36 g/mol
LogP3.34
Rot. Bonds3

About 1-(2,3-dimethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanol

1-(2,3-dimethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanol (PubChem CID 62797386) has the molecular formula C14H17NOS and a molecular weight of 247.36 g/mol. Its IUPAC name is 1-(2,3-dimethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanol.

Molecular Properties

Compound Name1-(2,3-dimethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanol
PubChem CID62797386
Molecular FormulaC14H17NOS
Molecular Weight247.36 g/mol
Exact Mass247.10
IUPAC Name1-(2,3-dimethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanol
SMILESCc1csc(CC(O)c2cccc(C)c2C)n1
InChIInChI=1S/C14H17NOS/c1-9-5-4-6-12(11(9)3)13(16)7-14-15-10(2)8-17-14/h4-6,8,13,16H,7H2,1-3H3
InChIKeyRTQMSKDVDPKZSM-UHFFFAOYSA-N
XLogP3.34
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.36
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(2,3-dimethylphenyl)-2-(4-methyl-1,3-thiazol-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

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dimethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanol?
The IUPAC name of 1-(2,3-dimethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanol (CID 62797386) is 1-(2,3-dimethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanol.
What is the SMILES notation for 1-(2,3-dimethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanol?
The canonical SMILES for 1-(2,3-dimethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanol is Cc1csc(CC(O)c2cccc(C)c2C)n1.
What is the InChIKey of 1-(2,3-dimethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanol?
The InChIKey is RTQMSKDVDPKZSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NOS/c1-9-5-4-6-12(11(9)3)13(16)7-14-15-10(2)8-17-14/h4-6,8,13,16H,7H2,1-3H3.
What are the key properties of 1-(2,3-dimethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanol?
1-(2,3-dimethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanol has a molecular weight of 247.36 g/mol, XLogP of 3.34, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dimethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanol is sourced from PubChem (CID 62797386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).