2-[2-(2-methoxy-5-methylphenyl)-1,3-thiazol-4-yl]propan-2-ol

C14H17NO2S — CID 116890545

IUPAC2-[2-(2-methoxy-5-methylphenyl)-1,3-thiazol-4-yl]propan-2-ol
SMILESCOc1ccc(C)cc1-c1nc(C(C)(C)O)cs1
InChIInChI=1S/C14H17NO2S/c1-9-5-6-11(17-4)10(7-9)13-15-12(8-18-13)14(2,3)16/h5-8,16H,1-4H3
InChIKeyFMFLJXUELBRTAZ-UHFFFAOYSA-N
MW263.36 g/mol
LogP3.35
Rot. Bonds3

About 2-[2-(2-methoxy-5-methylphenyl)-1,3-thiazol-4-yl]propan-2-ol

2-[2-(2-methoxy-5-methylphenyl)-1,3-thiazol-4-yl]propan-2-ol (PubChem CID 116890545) has the molecular formula C14H17NO2S and a molecular weight of 263.36 g/mol. Its IUPAC name is 2-[2-(2-methoxy-5-methylphenyl)-1,3-thiazol-4-yl]propan-2-ol.

Molecular Properties

Compound Name2-[2-(2-methoxy-5-methylphenyl)-1,3-thiazol-4-yl]propan-2-ol
PubChem CID116890545
Molecular FormulaC14H17NO2S
Molecular Weight263.36 g/mol
Exact Mass263.10
IUPAC Name2-[2-(2-methoxy-5-methylphenyl)-1,3-thiazol-4-yl]propan-2-ol
SMILESCOc1ccc(C)cc1-c1nc(C(C)(C)O)cs1
InChIInChI=1S/C14H17NO2S/c1-9-5-6-11(17-4)10(7-9)13-15-12(8-18-13)14(2,3)16/h5-8,16H,1-4H3
InChIKeyFMFLJXUELBRTAZ-UHFFFAOYSA-N
XLogP3.35
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 ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-(2-methoxy-5-methylphenyl)-1,3-thiazol-4-yl]ethanol
CID 82087185
[2-(2-methoxy-5-methylphenyl)-1,3-thiazol-4-yl]methanethiol
CID 116889454
2-(2-methoxy-5-methylphenyl)-4-phenyl-1,3-thiazole
CID 142708637
4-(2-chloroethyl)-2-(2-methoxy-5-methylphenyl)-1,3-thiazole
CID 116888989
2-[2-(3-methoxy-4-propoxyphenyl)-1,3-thiazol-4-yl]propan-2-ol
CID 82515913
2-[2-(3,4-dimethylphenyl)-1,3-thiazol-4-yl]propan-2-ol
CID 116890539
2-(2,5-dimethoxyphenyl)-4-methyl-1,3-thiazole
CID 82083376
2-(2-methoxy-5-methylphenyl)-4-methyl-1,3-thiazole-5-carboxylic acid
CID 82091190
4-bromo-2-(5-tert-butyl-2-methoxyphenyl)-1,3-thiazole
CID 116892178
2-chloro-5-(2-methoxy-5-methylphenyl)-1,3,4-thiadiazole
CID 63386396
3-(2-methoxy-5-methylphenyl)-4-methyl-1,2-oxazol-5-amine
CID 62505613
2-[2-(4-fluoro-3-methoxyphenyl)-1,3-thiazol-4-yl]-2-methylpropanoic acid
CID 107922554

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-methoxy-5-methylphenyl)-1,3-thiazol-4-yl]propan-2-ol?
The IUPAC name of 2-[2-(2-methoxy-5-methylphenyl)-1,3-thiazol-4-yl]propan-2-ol (CID 116890545) is 2-[2-(2-methoxy-5-methylphenyl)-1,3-thiazol-4-yl]propan-2-ol.
What is the SMILES notation for 2-[2-(2-methoxy-5-methylphenyl)-1,3-thiazol-4-yl]propan-2-ol?
The canonical SMILES for 2-[2-(2-methoxy-5-methylphenyl)-1,3-thiazol-4-yl]propan-2-ol is COc1ccc(C)cc1-c1nc(C(C)(C)O)cs1.
What is the InChIKey of 2-[2-(2-methoxy-5-methylphenyl)-1,3-thiazol-4-yl]propan-2-ol?
The InChIKey is FMFLJXUELBRTAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO2S/c1-9-5-6-11(17-4)10(7-9)13-15-12(8-18-13)14(2,3)16/h5-8,16H,1-4H3.
What are the key properties of 2-[2-(2-methoxy-5-methylphenyl)-1,3-thiazol-4-yl]propan-2-ol?
2-[2-(2-methoxy-5-methylphenyl)-1,3-thiazol-4-yl]propan-2-ol has a molecular weight of 263.36 g/mol, XLogP of 3.35, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-methoxy-5-methylphenyl)-1,3-thiazol-4-yl]propan-2-ol is sourced from PubChem (CID 116890545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).