[4-(2-methoxy-3,4,6-trimethylphenyl)-1,3-thiazol-2-yl]methanol

C14H17NO2S — CID 116867475

IUPAC[4-(2-methoxy-3,4,6-trimethylphenyl)-1,3-thiazol-2-yl]methanol
SMILESCOc1c(C)c(C)cc(C)c1-c1csc(CO)n1
InChIInChI=1S/C14H17NO2S/c1-8-5-9(2)13(14(17-4)10(8)3)11-7-18-12(6-16)15-11/h5,7,16H,6H2,1-4H3
InChIKeyPTXJWMSRQLAAFH-UHFFFAOYSA-N
MW263.36 g/mol
LogP3.24
Rot. Bonds3

About [4-(2-methoxy-3,4,6-trimethylphenyl)-1,3-thiazol-2-yl]methanol

[4-(2-methoxy-3,4,6-trimethylphenyl)-1,3-thiazol-2-yl]methanol (PubChem CID 116867475) has the molecular formula C14H17NO2S and a molecular weight of 263.36 g/mol. Its IUPAC name is [4-(2-methoxy-3,4,6-trimethylphenyl)-1,3-thiazol-2-yl]methanol.

Molecular Properties

Compound Name[4-(2-methoxy-3,4,6-trimethylphenyl)-1,3-thiazol-2-yl]methanol
PubChem CID116867475
Molecular FormulaC14H17NO2S
Molecular Weight263.36 g/mol
Exact Mass263.10
IUPAC Name[4-(2-methoxy-3,4,6-trimethylphenyl)-1,3-thiazol-2-yl]methanol
SMILESCOc1c(C)c(C)cc(C)c1-c1csc(CO)n1
InChIInChI=1S/C14H17NO2S/c1-8-5-9(2)13(14(17-4)10(8)3)11-7-18-12(6-16)15-11/h5,7,16H,6H2,1-4H3
InChIKeyPTXJWMSRQLAAFH-UHFFFAOYSA-N
XLogP3.24
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.36
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-chloro-4-(2-methoxy-3,4,6-trimethylphenyl)-1,3-thiazole
CID 116968145
[4-(2,4-dimethoxy-6-methylphenyl)-1,3-thiazol-2-yl]methanol
CID 116867467
2-(bromomethyl)-4-(4-methoxy-2,3,6-trimethylphenyl)-1,3-thiazole
CID 116970374
[6-(2-methoxy-3,4,6-trimethylphenyl)pyrimidin-4-yl]methanamine
CID 116857602
2-(bromomethyl)-4-(4-methoxy-2,3,5-trimethylphenyl)-1,3-thiazole
CID 116970317
[4-(4-methoxy-3,5-dimethylphenyl)-1,3-thiazol-2-yl]methanethiol
CID 116965938
[4-(5-bromo-2-methoxyphenyl)-1,3-thiazol-2-yl]methanol
CID 82124686
2-(bromomethyl)-4-(5-chloro-2-methoxy-3-methylphenyl)-1,3-thiazole
CID 116970319
[4-(2,5-dimethylfuran-3-yl)-1,3-thiazol-2-yl]methanol
CID 62923776
3-(2-methoxy-3,4,6-trimethylphenyl)-1,2-oxazol-5-amine
CID 115112351
2-[4-(4-methoxy-3,5-dimethylphenyl)-1,3-thiazol-2-yl]acetaldehyde
CID 116968883
2-[4-(2,4,6-trimethylphenyl)-1,3-thiazol-2-yl]acetic acid
CID 4316740

Frequently Asked Questions

What is the IUPAC name of [4-(2-methoxy-3,4,6-trimethylphenyl)-1,3-thiazol-2-yl]methanol?
The IUPAC name of [4-(2-methoxy-3,4,6-trimethylphenyl)-1,3-thiazol-2-yl]methanol (CID 116867475) is [4-(2-methoxy-3,4,6-trimethylphenyl)-1,3-thiazol-2-yl]methanol.
What is the SMILES notation for [4-(2-methoxy-3,4,6-trimethylphenyl)-1,3-thiazol-2-yl]methanol?
The canonical SMILES for [4-(2-methoxy-3,4,6-trimethylphenyl)-1,3-thiazol-2-yl]methanol is COc1c(C)c(C)cc(C)c1-c1csc(CO)n1.
What is the InChIKey of [4-(2-methoxy-3,4,6-trimethylphenyl)-1,3-thiazol-2-yl]methanol?
The InChIKey is PTXJWMSRQLAAFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO2S/c1-8-5-9(2)13(14(17-4)10(8)3)11-7-18-12(6-16)15-11/h5,7,16H,6H2,1-4H3.
What are the key properties of [4-(2-methoxy-3,4,6-trimethylphenyl)-1,3-thiazol-2-yl]methanol?
[4-(2-methoxy-3,4,6-trimethylphenyl)-1,3-thiazol-2-yl]methanol has a molecular weight of 263.36 g/mol, XLogP of 3.24, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-methoxy-3,4,6-trimethylphenyl)-1,3-thiazol-2-yl]methanol is sourced from PubChem (CID 116867475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).