1-[4-(4-methoxy-2,3-dimethylphenyl)-1,3-thiazol-2-yl]ethanol

C14H17NO2S — CID 116867574

IUPAC1-[4-(4-methoxy-2,3-dimethylphenyl)-1,3-thiazol-2-yl]ethanol
SMILESCOc1ccc(-c2csc(C(C)O)n2)c(C)c1C
InChIInChI=1S/C14H17NO2S/c1-8-9(2)13(17-4)6-5-11(8)12-7-18-14(15-12)10(3)16/h5-7,10,16H,1-4H3
InChIKeyYXLUBGMMTDTZDF-UHFFFAOYSA-N
MW263.36 g/mol
LogP3.49
Rot. Bonds3

About 1-[4-(4-methoxy-2,3-dimethylphenyl)-1,3-thiazol-2-yl]ethanol

1-[4-(4-methoxy-2,3-dimethylphenyl)-1,3-thiazol-2-yl]ethanol (PubChem CID 116867574) has the molecular formula C14H17NO2S and a molecular weight of 263.36 g/mol. Its IUPAC name is 1-[4-(4-methoxy-2,3-dimethylphenyl)-1,3-thiazol-2-yl]ethanol.

Molecular Properties

Compound Name1-[4-(4-methoxy-2,3-dimethylphenyl)-1,3-thiazol-2-yl]ethanol
PubChem CID116867574
Molecular FormulaC14H17NO2S
Molecular Weight263.36 g/mol
Exact Mass263.10
IUPAC Name1-[4-(4-methoxy-2,3-dimethylphenyl)-1,3-thiazol-2-yl]ethanol
SMILESCOc1ccc(-c2csc(C(C)O)n2)c(C)c1C
InChIInChI=1S/C14H17NO2S/c1-8-9(2)13(17-4)6-5-11(8)12-7-18-14(15-12)10(3)16/h5-7,10,16H,1-4H3
InChIKeyYXLUBGMMTDTZDF-UHFFFAOYSA-N
XLogP3.49
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 ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-ethyl-4-(4-methoxy-2,3-dimethylphenyl)-1,3-thiazole
CID 116970066
[4-(4-methoxy-2,3-dimethylphenyl)-1,3-thiazol-2-yl]methylhydrazine
CID 116970211
2-[4-(4-methoxy-2,3-dimethylphenyl)-1,3-thiazol-2-yl]acetonitrile
CID 82300637
2-bromo-4-(2,4-dimethoxy-3-methylphenyl)-1,3-thiazole
CID 116968047
1-[4-(2-methyl-5-propan-2-ylphenyl)-1,3-thiazol-2-yl]ethanol
CID 116867576
1-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]ethanol
CID 63379443
1-[4-(2,3,5,6-tetramethylphenyl)-1,3-thiazol-2-yl]ethanol
CID 116867562
1-[4-(2,5-dichlorophenyl)-1,3-thiazol-2-yl]ethanol
CID 63524563
1-[4-(2,4-dimethoxyphenyl)-1,3-thiazol-2-yl]ethanamine;hydrochloride
CID 120580478
6-(4-methoxy-2,3-dimethylphenyl)pyridazin-3-amine
CID 82474066
4-(4-methoxy-2,3-dimethylphenyl)-6-propan-2-ylpyrimidin-2-amine
CID 95474541
1-[4-(2-nitrophenyl)-1,3-thiazol-2-yl]ethanol
CID 63379311

Frequently Asked Questions

What is the IUPAC name of 1-[4-(4-methoxy-2,3-dimethylphenyl)-1,3-thiazol-2-yl]ethanol?
The IUPAC name of 1-[4-(4-methoxy-2,3-dimethylphenyl)-1,3-thiazol-2-yl]ethanol (CID 116867574) is 1-[4-(4-methoxy-2,3-dimethylphenyl)-1,3-thiazol-2-yl]ethanol.
What is the SMILES notation for 1-[4-(4-methoxy-2,3-dimethylphenyl)-1,3-thiazol-2-yl]ethanol?
The canonical SMILES for 1-[4-(4-methoxy-2,3-dimethylphenyl)-1,3-thiazol-2-yl]ethanol is COc1ccc(-c2csc(C(C)O)n2)c(C)c1C.
What is the InChIKey of 1-[4-(4-methoxy-2,3-dimethylphenyl)-1,3-thiazol-2-yl]ethanol?
The InChIKey is YXLUBGMMTDTZDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO2S/c1-8-9(2)13(17-4)6-5-11(8)12-7-18-14(15-12)10(3)16/h5-7,10,16H,1-4H3.
What are the key properties of 1-[4-(4-methoxy-2,3-dimethylphenyl)-1,3-thiazol-2-yl]ethanol?
1-[4-(4-methoxy-2,3-dimethylphenyl)-1,3-thiazol-2-yl]ethanol has a molecular weight of 263.36 g/mol, XLogP of 3.49, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(4-methoxy-2,3-dimethylphenyl)-1,3-thiazol-2-yl]ethanol is sourced from PubChem (CID 116867574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).