2-(2-methoxy-4,5-dimethylphenyl)-4-methyl-1,3-thiazol-5-ol

C13H15NO2S — CID 116886039

IUPAC2-(2-methoxy-4,5-dimethylphenyl)-4-methyl-1,3-thiazol-5-ol
SMILESCOc1cc(C)c(C)cc1-c1nc(C)c(O)s1
InChIInChI=1S/C13H15NO2S/c1-7-5-10(11(16-4)6-8(7)2)12-14-9(3)13(15)17-12/h5-6,15H,1-4H3
InChIKeyQQENLONQYZZBDX-UHFFFAOYSA-N
MW249.33 g/mol
LogP3.45
Rot. Bonds2

About 2-(2-methoxy-4,5-dimethylphenyl)-4-methyl-1,3-thiazol-5-ol

2-(2-methoxy-4,5-dimethylphenyl)-4-methyl-1,3-thiazol-5-ol (PubChem CID 116886039) has the molecular formula C13H15NO2S and a molecular weight of 249.33 g/mol. Its IUPAC name is 2-(2-methoxy-4,5-dimethylphenyl)-4-methyl-1,3-thiazol-5-ol.

Molecular Properties

Compound Name2-(2-methoxy-4,5-dimethylphenyl)-4-methyl-1,3-thiazol-5-ol
PubChem CID116886039
Molecular FormulaC13H15NO2S
Molecular Weight249.33 g/mol
Exact Mass249.08
IUPAC Name2-(2-methoxy-4,5-dimethylphenyl)-4-methyl-1,3-thiazol-5-ol
SMILESCOc1cc(C)c(C)cc1-c1nc(C)c(O)s1
InChIInChI=1S/C13H15NO2S/c1-7-5-10(11(16-4)6-8(7)2)12-14-9(3)13(15)17-12/h5-6,15H,1-4H3
InChIKeyQQENLONQYZZBDX-UHFFFAOYSA-N
XLogP3.45
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.33
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-bromo-2-(2,5-dimethoxy-4-methylphenyl)-4-methyl-1,3-thiazole
CID 116887902
2-(3-ethyl-4-methoxyphenyl)-4-methyl-1,3-thiazol-5-ol
CID 116886049
2-(4-methoxy-3-propan-2-ylphenyl)-4-methyl-1,3-thiazol-5-ol
CID 116886031
methyl 4-methyl-2-(2,4,5-trimethylphenyl)-1,3-thiazole-5-carboxylate
CID 114078260
2-bromo-4-(2-methoxy-4,5-dimethylphenyl)-5-methyl-1,3-thiazole
CID 82135463
2-(2,5-dimethoxyphenyl)-5-methoxy-4-methyl-1,3-thiazole
CID 116887517
2-(2-methoxy-4-methylphenyl)-4-methyl-1,3-thiazole-5-carboxylic acid
CID 68641689
2-(2-methoxy-4-propan-2-ylphenyl)-4-methyl-1,3-thiazol-5-amine
CID 116864511
2-(2-methoxy-5-methylphenyl)-4-methyl-1,3-thiazole-5-carboxylic acid
CID 82091190
2-(5-bromo-2-methoxyphenyl)-5-methoxy-4-methyl-1,3-thiazole
CID 116887531
5-bromo-2-(4-methoxy-2,5-dimethylphenyl)-1,3-thiazol-4-amine
CID 116864302
2-(4-methoxy-2,3,6-trimethylphenyl)-4,5-dimethyl-1,3-thiazole
CID 116887692

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxy-4,5-dimethylphenyl)-4-methyl-1,3-thiazol-5-ol?
The IUPAC name of 2-(2-methoxy-4,5-dimethylphenyl)-4-methyl-1,3-thiazol-5-ol (CID 116886039) is 2-(2-methoxy-4,5-dimethylphenyl)-4-methyl-1,3-thiazol-5-ol.
What is the SMILES notation for 2-(2-methoxy-4,5-dimethylphenyl)-4-methyl-1,3-thiazol-5-ol?
The canonical SMILES for 2-(2-methoxy-4,5-dimethylphenyl)-4-methyl-1,3-thiazol-5-ol is COc1cc(C)c(C)cc1-c1nc(C)c(O)s1.
What is the InChIKey of 2-(2-methoxy-4,5-dimethylphenyl)-4-methyl-1,3-thiazol-5-ol?
The InChIKey is QQENLONQYZZBDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO2S/c1-7-5-10(11(16-4)6-8(7)2)12-14-9(3)13(15)17-12/h5-6,15H,1-4H3.
What are the key properties of 2-(2-methoxy-4,5-dimethylphenyl)-4-methyl-1,3-thiazol-5-ol?
2-(2-methoxy-4,5-dimethylphenyl)-4-methyl-1,3-thiazol-5-ol has a molecular weight of 249.33 g/mol, XLogP of 3.45, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxy-4,5-dimethylphenyl)-4-methyl-1,3-thiazol-5-ol is sourced from PubChem (CID 116886039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).