2-(4-methoxy-2,3,6-trimethylphenyl)-4,5-dimethyl-1,3-thiazole

C15H19NOS — CID 116887692

IUPAC2-(4-methoxy-2,3,6-trimethylphenyl)-4,5-dimethyl-1,3-thiazole
SMILESCOc1cc(C)c(-c2nc(C)c(C)s2)c(C)c1C
InChIInChI=1S/C15H19NOS/c1-8-7-13(17-6)9(2)10(3)14(8)15-16-11(4)12(5)18-15/h7H,1-6H3
InChIKeyRMFYEBAQTIXNBG-UHFFFAOYSA-N
MW261.39 g/mol
LogP4.36
Rot. Bonds2

About 2-(4-methoxy-2,3,6-trimethylphenyl)-4,5-dimethyl-1,3-thiazole

2-(4-methoxy-2,3,6-trimethylphenyl)-4,5-dimethyl-1,3-thiazole (PubChem CID 116887692) has the molecular formula C15H19NOS and a molecular weight of 261.39 g/mol. Its IUPAC name is 2-(4-methoxy-2,3,6-trimethylphenyl)-4,5-dimethyl-1,3-thiazole.

Molecular Properties

Compound Name2-(4-methoxy-2,3,6-trimethylphenyl)-4,5-dimethyl-1,3-thiazole
PubChem CID116887692
Molecular FormulaC15H19NOS
Molecular Weight261.39 g/mol
Exact Mass261.12
IUPAC Name2-(4-methoxy-2,3,6-trimethylphenyl)-4,5-dimethyl-1,3-thiazole
SMILESCOc1cc(C)c(-c2nc(C)c(C)s2)c(C)c1C
InChIInChI=1S/C15H19NOS/c1-8-7-13(17-6)9(2)10(3)14(8)15-16-11(4)12(5)18-15/h7H,1-6H3
InChIKeyRMFYEBAQTIXNBG-UHFFFAOYSA-N
XLogP4.36
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.39
LogP ≤ 54.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-(4-methoxy-2,3,6-trimethylphenyl)-3-methyl-1,2-oxazole
CID 116869004
2-[3-(6,7-dimethoxyquinolin-4-yl)oxy-5,6-dimethyl-2-pyridinyl]-4,5-dimethyl-1,3-thiazole
CID 23156647
2-(bromomethyl)-4-(4-methoxy-2,3,6-trimethylphenyl)-1,3-thiazole
CID 116970374
[2-(2-methoxy-4,6-dimethylphenyl)-4-methyl-1,3-thiazol-5-yl]methanamine
CID 116868171
2-(2-methoxy-4,5-dimethylphenyl)-4-methyl-1,3-thiazol-5-ol
CID 116886039
2-(3,5-difluorophenyl)-4,5-dimethyl-1,3-thiazole
CID 58992623
[3-(4-methoxy-2,3,6-trimethylphenyl)-1,2,4-oxadiazol-5-yl]methanamine
CID 115112733
5-bromo-2-(2,5-dimethoxy-4-methylphenyl)-4-methyl-1,3-thiazole
CID 116887902
1,2,3-trimethoxy-5-methyl-4-(2,3,4-trimethoxy-6-methylphenyl)benzene
CID 20758550
6-amino-2-(4-methoxy-2,3,6-trimethylphenyl)pyrimidine-4-carbonitrile
CID 116862722
4-ethyl-5-(4-methoxy-2,3,6-trimethylphenyl)-1,3-oxazol-2-amine
CID 116832119
6-methoxy-N,4,5-trimethyl-1,3-benzothiazol-2-amine
CID 82548705

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxy-2,3,6-trimethylphenyl)-4,5-dimethyl-1,3-thiazole?
The IUPAC name of 2-(4-methoxy-2,3,6-trimethylphenyl)-4,5-dimethyl-1,3-thiazole (CID 116887692) is 2-(4-methoxy-2,3,6-trimethylphenyl)-4,5-dimethyl-1,3-thiazole.
What is the SMILES notation for 2-(4-methoxy-2,3,6-trimethylphenyl)-4,5-dimethyl-1,3-thiazole?
The canonical SMILES for 2-(4-methoxy-2,3,6-trimethylphenyl)-4,5-dimethyl-1,3-thiazole is COc1cc(C)c(-c2nc(C)c(C)s2)c(C)c1C.
What is the InChIKey of 2-(4-methoxy-2,3,6-trimethylphenyl)-4,5-dimethyl-1,3-thiazole?
The InChIKey is RMFYEBAQTIXNBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NOS/c1-8-7-13(17-6)9(2)10(3)14(8)15-16-11(4)12(5)18-15/h7H,1-6H3.
What are the key properties of 2-(4-methoxy-2,3,6-trimethylphenyl)-4,5-dimethyl-1,3-thiazole?
2-(4-methoxy-2,3,6-trimethylphenyl)-4,5-dimethyl-1,3-thiazole has a molecular weight of 261.39 g/mol, XLogP of 4.36, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxy-2,3,6-trimethylphenyl)-4,5-dimethyl-1,3-thiazole is sourced from PubChem (CID 116887692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).