2-(3-ethyl-4-methoxyphenyl)-4-methyl-1,3-thiazol-5-ol

C13H15NO2S — CID 116886049

IUPAC2-(3-ethyl-4-methoxyphenyl)-4-methyl-1,3-thiazol-5-ol
SMILESCCc1cc(-c2nc(C)c(O)s2)ccc1OC
InChIInChI=1S/C13H15NO2S/c1-4-9-7-10(5-6-11(9)16-3)12-14-8(2)13(15)17-12/h5-7,15H,4H2,1-3H3
InChIKeyVIYKPJQHSVOSDK-UHFFFAOYSA-N
MW249.33 g/mol
LogP3.40
Rot. Bonds3

About 2-(3-ethyl-4-methoxyphenyl)-4-methyl-1,3-thiazol-5-ol

2-(3-ethyl-4-methoxyphenyl)-4-methyl-1,3-thiazol-5-ol (PubChem CID 116886049) has the molecular formula C13H15NO2S and a molecular weight of 249.33 g/mol. Its IUPAC name is 2-(3-ethyl-4-methoxyphenyl)-4-methyl-1,3-thiazol-5-ol.

Molecular Properties

Compound Name2-(3-ethyl-4-methoxyphenyl)-4-methyl-1,3-thiazol-5-ol
PubChem CID116886049
Molecular FormulaC13H15NO2S
Molecular Weight249.33 g/mol
Exact Mass249.08
IUPAC Name2-(3-ethyl-4-methoxyphenyl)-4-methyl-1,3-thiazol-5-ol
SMILESCCc1cc(-c2nc(C)c(O)s2)ccc1OC
InChIInChI=1S/C13H15NO2S/c1-4-9-7-10(5-6-11(9)16-3)12-14-8(2)13(15)17-12/h5-7,15H,4H2,1-3H3
InChIKeyVIYKPJQHSVOSDK-UHFFFAOYSA-N
XLogP3.40
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.33
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-methoxy-3-propan-2-ylphenyl)-4-methyl-1,3-thiazol-5-ol
CID 116886031
[5-bromo-2-(3-ethyl-4-methoxyphenyl)-1,3-thiazol-4-yl]methanol
CID 84608504
4-(3-ethyl-4-methoxyphenyl)-2-methyl-1,3-thiazole
CID 116967837
4-(3-ethyl-4-methoxyphenyl)-5-methylthiophene-2-carboxylic acid
CID 94285195
1-[2-(3-hydroxy-4-methoxyphenyl)-4-methyl-1,3-thiazol-5-yl]ethanone
CID 61288983
2-(2-methoxy-4,5-dimethylphenyl)-4-methyl-1,3-thiazol-5-ol
CID 116886039
4-methyl-2-(4-propylphenyl)-1,3-thiazol-5-ol
CID 116886026
2-(3-ethoxy-4-methoxyphenyl)-4-methyl-1,3-thiazole-5-carboxylic acid
CID 20991152
2-[2-(4-ethoxy-3-methoxyphenyl)-4-methyl-1,3-thiazol-5-yl]propan-2-ol
CID 82427189
2-(3,4-dimethoxyphenyl)-N-ethyl-N-(2-hydroxyethyl)-4-methyl-1,3-thiazole-5-carboxamide
CID 78855524
2-(4-fluorophenyl)-4-methyl-1,3-thiazol-5-ol
CID 116886009
4-methyl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,3-thiazol-5-ol
CID 116886008

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethyl-4-methoxyphenyl)-4-methyl-1,3-thiazol-5-ol?
The IUPAC name of 2-(3-ethyl-4-methoxyphenyl)-4-methyl-1,3-thiazol-5-ol (CID 116886049) is 2-(3-ethyl-4-methoxyphenyl)-4-methyl-1,3-thiazol-5-ol.
What is the SMILES notation for 2-(3-ethyl-4-methoxyphenyl)-4-methyl-1,3-thiazol-5-ol?
The canonical SMILES for 2-(3-ethyl-4-methoxyphenyl)-4-methyl-1,3-thiazol-5-ol is CCc1cc(-c2nc(C)c(O)s2)ccc1OC.
What is the InChIKey of 2-(3-ethyl-4-methoxyphenyl)-4-methyl-1,3-thiazol-5-ol?
The InChIKey is VIYKPJQHSVOSDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO2S/c1-4-9-7-10(5-6-11(9)16-3)12-14-8(2)13(15)17-12/h5-7,15H,4H2,1-3H3.
What are the key properties of 2-(3-ethyl-4-methoxyphenyl)-4-methyl-1,3-thiazol-5-ol?
2-(3-ethyl-4-methoxyphenyl)-4-methyl-1,3-thiazol-5-ol has a molecular weight of 249.33 g/mol, XLogP of 3.40, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethyl-4-methoxyphenyl)-4-methyl-1,3-thiazol-5-ol is sourced from PubChem (CID 116886049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).