2-[2-(2-methoxy-5-methylphenyl)-1,3-thiazol-4-yl]ethanol

C13H15NO2S — CID 82087185

IUPAC2-[2-(2-methoxy-5-methylphenyl)-1,3-thiazol-4-yl]ethanol
SMILESCOc1ccc(C)cc1-c1nc(CCO)cs1
InChIInChI=1S/C13H15NO2S/c1-9-3-4-12(16-2)11(7-9)13-14-10(5-6-15)8-17-13/h3-4,7-8,15H,5-6H2,1-2H3
InChIKeyCPPZHYCFPLZXSG-UHFFFAOYSA-N
MW249.33 g/mol
LogP2.66
Rot. Bonds4

About 2-[2-(2-methoxy-5-methylphenyl)-1,3-thiazol-4-yl]ethanol

2-[2-(2-methoxy-5-methylphenyl)-1,3-thiazol-4-yl]ethanol (PubChem CID 82087185) has the molecular formula C13H15NO2S and a molecular weight of 249.33 g/mol. Its IUPAC name is 2-[2-(2-methoxy-5-methylphenyl)-1,3-thiazol-4-yl]ethanol.

Molecular Properties

Compound Name2-[2-(2-methoxy-5-methylphenyl)-1,3-thiazol-4-yl]ethanol
PubChem CID82087185
Molecular FormulaC13H15NO2S
Molecular Weight249.33 g/mol
Exact Mass249.08
IUPAC Name2-[2-(2-methoxy-5-methylphenyl)-1,3-thiazol-4-yl]ethanol
SMILESCOc1ccc(C)cc1-c1nc(CCO)cs1
InChIInChI=1S/C13H15NO2S/c1-9-3-4-12(16-2)11(7-9)13-14-10(5-6-15)8-17-13/h3-4,7-8,15H,5-6H2,1-2H3
InChIKeyCPPZHYCFPLZXSG-UHFFFAOYSA-N
XLogP2.66
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.33
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(2-chloroethyl)-2-(2-methoxy-5-methylphenyl)-1,3-thiazole
CID 116888989
[2-(2-methoxy-5-methylphenyl)-1,3-thiazol-4-yl]methanethiol
CID 116889454
[2-(2,5-dimethoxyphenyl)-1,3-thiazol-4-yl]methanol
CID 39354147
2-[2-(2-methoxy-5-methylphenyl)-1,3-thiazol-4-yl]propan-2-ol
CID 116890545
2-(2-methoxy-5-methylphenyl)-4-phenyl-1,3-thiazole
CID 142708637
2-[2-(5-bromo-2-methoxyphenyl)-1,3-thiazol-4-yl]-N-methylethanamine
CID 116888128
3-[2-(5-bromo-2-methoxyphenyl)-1,3-thiazol-4-yl]propan-1-amine
CID 116888272
4-(2-bromoethyl)-2-(2-methoxyphenyl)-1,3-thiazole
CID 82094625
1-[2-(5-fluoro-2-methoxyphenyl)-1,3-thiazol-4-yl]propan-2-one
CID 116890244
[2-(5-ethyl-2-methoxyphenyl)-1,3-thiazol-4-yl]methanethiol
CID 116889475
2-(3,4-dimethoxyphenyl)-4-propyl-1,3-thiazole
CID 112692422
2-[2-(5-methylthiophen-2-yl)-1,3-thiazol-4-yl]ethanol
CID 115089075

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-methoxy-5-methylphenyl)-1,3-thiazol-4-yl]ethanol?
The IUPAC name of 2-[2-(2-methoxy-5-methylphenyl)-1,3-thiazol-4-yl]ethanol (CID 82087185) is 2-[2-(2-methoxy-5-methylphenyl)-1,3-thiazol-4-yl]ethanol.
What is the SMILES notation for 2-[2-(2-methoxy-5-methylphenyl)-1,3-thiazol-4-yl]ethanol?
The canonical SMILES for 2-[2-(2-methoxy-5-methylphenyl)-1,3-thiazol-4-yl]ethanol is COc1ccc(C)cc1-c1nc(CCO)cs1.
What is the InChIKey of 2-[2-(2-methoxy-5-methylphenyl)-1,3-thiazol-4-yl]ethanol?
The InChIKey is CPPZHYCFPLZXSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO2S/c1-9-3-4-12(16-2)11(7-9)13-14-10(5-6-15)8-17-13/h3-4,7-8,15H,5-6H2,1-2H3.
What are the key properties of 2-[2-(2-methoxy-5-methylphenyl)-1,3-thiazol-4-yl]ethanol?
2-[2-(2-methoxy-5-methylphenyl)-1,3-thiazol-4-yl]ethanol has a molecular weight of 249.33 g/mol, XLogP of 2.66, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-methoxy-5-methylphenyl)-1,3-thiazol-4-yl]ethanol is sourced from PubChem (CID 82087185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).