1-(2-methoxy-4,6-dimethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanol

C15H19NO2S — CID 106680177

IUPAC1-(2-methoxy-4,6-dimethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanol
SMILESCOc1cc(C)cc(C)c1C(O)Cc1nc(C)cs1
InChIInChI=1S/C15H19NO2S/c1-9-5-10(2)15(13(6-9)18-4)12(17)7-14-16-11(3)8-19-14/h5-6,8,12,17H,7H2,1-4H3
InChIKeySWDFNXZXTNRSMS-UHFFFAOYSA-N
MW277.39 g/mol
LogP3.35
Rot. Bonds4

About 1-(2-methoxy-4,6-dimethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanol

1-(2-methoxy-4,6-dimethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanol (PubChem CID 106680177) has the molecular formula C15H19NO2S and a molecular weight of 277.39 g/mol. Its IUPAC name is 1-(2-methoxy-4,6-dimethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanol.

Molecular Properties

Compound Name1-(2-methoxy-4,6-dimethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanol
PubChem CID106680177
Molecular FormulaC15H19NO2S
Molecular Weight277.39 g/mol
Exact Mass277.11
IUPAC Name1-(2-methoxy-4,6-dimethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanol
SMILESCOc1cc(C)cc(C)c1C(O)Cc1nc(C)cs1
InChIInChI=1S/C15H19NO2S/c1-9-5-10(2)15(13(6-9)18-4)12(17)7-14-16-11(3)8-19-14/h5-6,8,12,17H,7H2,1-4H3
InChIKeySWDFNXZXTNRSMS-UHFFFAOYSA-N
XLogP3.35
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.39
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3,5-dimethylphenyl)-1-(2-methoxy-4,6-dimethylphenyl)ethanol
CID 106680174
(2-methoxy-4,6-dimethylphenyl)-(2-methyl-1,3-thiazol-4-yl)methanol
CID 106679764
[1-(2-methoxy-4-methylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethyl]hydrazine
CID 106793984
1-(2-methoxy-4,6-dimethylphenyl)-2-pyridin-2-ylethanol
CID 106680148
2-(3,4-difluorophenyl)-1-(2-methoxy-4,6-dimethylphenyl)ethanol
CID 106682618
3,3,3-trifluoro-1-(2-methoxy-4,6-dimethylphenyl)propan-1-ol
CID 106680156
N-[2-(4-methyl-1,3-thiazol-2-yl)-1-(2,4,6-trimethylphenyl)ethyl]propan-1-amine
CID 105019392
1-(2-methoxy-4,6-dimethylphenyl)-2-[(2-methylpropan-2-yl)oxy]ethanol
CID 106682653
1-(5-bromo-4-methylthiophen-2-yl)-2-(4-methyl-1,3-thiazol-2-yl)ethanol
CID 115824159
1-(2-methoxy-4,6-dimethylphenyl)-2-propoxyethanol
CID 106680167
1-(2-methoxy-4,6-dimethylphenyl)-2-(thian-4-yl)ethanol
CID 106682608
2-amino-2-(2-methoxy-4,6-dimethylphenyl)ethanol
CID 77129779

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxy-4,6-dimethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanol?
The IUPAC name of 1-(2-methoxy-4,6-dimethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanol (CID 106680177) is 1-(2-methoxy-4,6-dimethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanol.
What is the SMILES notation for 1-(2-methoxy-4,6-dimethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanol?
The canonical SMILES for 1-(2-methoxy-4,6-dimethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanol is COc1cc(C)cc(C)c1C(O)Cc1nc(C)cs1.
What is the InChIKey of 1-(2-methoxy-4,6-dimethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanol?
The InChIKey is SWDFNXZXTNRSMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO2S/c1-9-5-10(2)15(13(6-9)18-4)12(17)7-14-16-11(3)8-19-14/h5-6,8,12,17H,7H2,1-4H3.
What are the key properties of 1-(2-methoxy-4,6-dimethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanol?
1-(2-methoxy-4,6-dimethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanol has a molecular weight of 277.39 g/mol, XLogP of 3.35, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxy-4,6-dimethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanol is sourced from PubChem (CID 106680177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).