2-(2,4-dimethoxy-6-methylphenyl)-4-methyl-1,3-thiazole

C13H15NO2S — CID 116891940

IUPAC2-(2,4-dimethoxy-6-methylphenyl)-4-methyl-1,3-thiazole
SMILESCOc1cc(C)c(-c2nc(C)cs2)c(OC)c1
InChIInChI=1S/C13H15NO2S/c1-8-5-10(15-3)6-11(16-4)12(8)13-14-9(2)7-17-13/h5-7H,1-4H3
InChIKeyUXOHAZZVVLHXFV-UHFFFAOYSA-N
MW249.33 g/mol
LogP3.44
Rot. Bonds3

About 2-(2,4-dimethoxy-6-methylphenyl)-4-methyl-1,3-thiazole

2-(2,4-dimethoxy-6-methylphenyl)-4-methyl-1,3-thiazole (PubChem CID 116891940) has the molecular formula C13H15NO2S and a molecular weight of 249.33 g/mol. Its IUPAC name is 2-(2,4-dimethoxy-6-methylphenyl)-4-methyl-1,3-thiazole.

Molecular Properties

Compound Name2-(2,4-dimethoxy-6-methylphenyl)-4-methyl-1,3-thiazole
PubChem CID116891940
Molecular FormulaC13H15NO2S
Molecular Weight249.33 g/mol
Exact Mass249.08
IUPAC Name2-(2,4-dimethoxy-6-methylphenyl)-4-methyl-1,3-thiazole
SMILESCOc1cc(C)c(-c2nc(C)cs2)c(OC)c1
InChIInChI=1S/C13H15NO2S/c1-8-5-10(15-3)6-11(16-4)12(8)13-14-9(2)7-17-13/h5-7H,1-4H3
InChIKeyUXOHAZZVVLHXFV-UHFFFAOYSA-N
XLogP3.44
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.33
LogP ≤ 53.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5-(2,4-dimethoxy-6-methylphenyl)-3-methyl-1,2-oxazole
CID 116868995
2-(2,5-dimethoxyphenyl)-4-methyl-1,3-thiazole
CID 82083376
4-methyl-2-(2,4,6-trimethylphenyl)-1,3-thiazole
CID 116891883
[4-(2,4-dimethoxy-6-methylphenyl)-1,3-thiazol-2-yl]methanol
CID 116867467
4-methyl-2-(2,4,5-trimethylphenyl)-1,3-thiazole
CID 116891909
[2-(2-methoxy-4,6-dimethylphenyl)-1,3-thiazol-4-yl]hydrazine
CID 116892118
2-bromo-4-(2,4-dimethoxy-6-methylphenyl)-6-methylpyrimidine
CID 116897316
3,5-dimethoxy-2-(4-phenyl-1,3-thiazol-2-yl)phenol
CID 136785678
3-(4-methoxy-2,6-dimethylphenyl)-5-methyl-1,2,4-oxadiazole
CID 13237457
4-(2,4-dimethoxy-6-methylphenyl)-2-methoxypyrimidine
CID 116903822
3,5-dimethyl-2,6-bis(2,4,6-trimethoxyphenyl)aniline
CID 102009274
4-(2,4-dimethoxy-6-methylphenyl)pyrimidin-2-amine
CID 116900504

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethoxy-6-methylphenyl)-4-methyl-1,3-thiazole?
The IUPAC name of 2-(2,4-dimethoxy-6-methylphenyl)-4-methyl-1,3-thiazole (CID 116891940) is 2-(2,4-dimethoxy-6-methylphenyl)-4-methyl-1,3-thiazole.
What is the SMILES notation for 2-(2,4-dimethoxy-6-methylphenyl)-4-methyl-1,3-thiazole?
The canonical SMILES for 2-(2,4-dimethoxy-6-methylphenyl)-4-methyl-1,3-thiazole is COc1cc(C)c(-c2nc(C)cs2)c(OC)c1.
What is the InChIKey of 2-(2,4-dimethoxy-6-methylphenyl)-4-methyl-1,3-thiazole?
The InChIKey is UXOHAZZVVLHXFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO2S/c1-8-5-10(15-3)6-11(16-4)12(8)13-14-9(2)7-17-13/h5-7H,1-4H3.
What are the key properties of 2-(2,4-dimethoxy-6-methylphenyl)-4-methyl-1,3-thiazole?
2-(2,4-dimethoxy-6-methylphenyl)-4-methyl-1,3-thiazole has a molecular weight of 249.33 g/mol, XLogP of 3.44, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethoxy-6-methylphenyl)-4-methyl-1,3-thiazole is sourced from PubChem (CID 116891940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).