2-[2-[2-(2-methylphenoxy)ethyl]-1,3-thiazol-5-yl]propan-2-ol

C15H19NO2S — CID 82423770

IUPAC2-[2-[2-(2-methylphenoxy)ethyl]-1,3-thiazol-5-yl]propan-2-ol
SMILESCc1ccccc1OCCc1ncc(C(C)(C)O)s1
InChIInChI=1S/C15H19NO2S/c1-11-6-4-5-7-12(11)18-9-8-14-16-10-13(19-14)15(2,3)17/h4-7,10,17H,8-9H2,1-3H3
InChIKeyUHOFYLSDYYNRHI-UHFFFAOYSA-N
MW277.39 g/mol
LogP3.30
Rot. Bonds5

About 2-[2-[2-(2-methylphenoxy)ethyl]-1,3-thiazol-5-yl]propan-2-ol

2-[2-[2-(2-methylphenoxy)ethyl]-1,3-thiazol-5-yl]propan-2-ol (PubChem CID 82423770) has the molecular formula C15H19NO2S and a molecular weight of 277.39 g/mol. Its IUPAC name is 2-[2-[2-(2-methylphenoxy)ethyl]-1,3-thiazol-5-yl]propan-2-ol.

Molecular Properties

Compound Name2-[2-[2-(2-methylphenoxy)ethyl]-1,3-thiazol-5-yl]propan-2-ol
PubChem CID82423770
Molecular FormulaC15H19NO2S
Molecular Weight277.39 g/mol
Exact Mass277.11
IUPAC Name2-[2-[2-(2-methylphenoxy)ethyl]-1,3-thiazol-5-yl]propan-2-ol
SMILESCc1ccccc1OCCc1ncc(C(C)(C)O)s1
InChIInChI=1S/C15H19NO2S/c1-11-6-4-5-7-12(11)18-9-8-14-16-10-13(19-14)15(2,3)17/h4-7,10,17H,8-9H2,1-3H3
InChIKeyUHOFYLSDYYNRHI-UHFFFAOYSA-N
XLogP3.30
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.39
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-(2-methylphenoxy)ethyl]-1,3-thiazole-5-carboxylic acid
CID 82191076
4-methyl-2-[2-(2-methylphenoxy)ethyl]-1,3-thiazole-5-carboxylic acid
CID 4874792
2-[2-[2-(2,6-dimethylphenoxy)ethyl]-4-methyl-1,3-thiazol-5-yl]propan-2-ol
CID 82426840
1-[4-ethyl-2-[2-(2-methylphenoxy)ethyl]-1,3-thiazol-5-yl]ethanone
CID 82429727
2-[2-(2,3-dimethylphenoxy)ethyl]-1,3-thiazole-5-carbohydrazide
CID 82423897
[2-[2-(2-methylphenoxy)ethyl]-1,3-thiazol-4-yl]methanamine
CID 82104670
1-[2-[2-(2-methylphenoxy)ethyl]-4-propyl-1,3-thiazol-5-yl]ethanone
CID 82432483
[2-[(2-methylphenoxy)methyl]-1,3-thiazol-5-yl]methanol
CID 82190879
ethane;2-methyl-1-(2-methylphenoxy)propan-2-ol
CID 177208153
3,5-dimethyl-4-[2-(2-methylphenoxy)ethyl]-1H-pyrazole
CID 879148
1-[4-ethyl-2-[2-(2-methylphenoxy)ethyl]-1,3-thiazol-5-yl]ethanamine
CID 82429728
2-[2-(2-propan-2-ylphenoxy)ethyl]-1,3-thiazole-5-carbothioamide
CID 82423853

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-(2-methylphenoxy)ethyl]-1,3-thiazol-5-yl]propan-2-ol?
The IUPAC name of 2-[2-[2-(2-methylphenoxy)ethyl]-1,3-thiazol-5-yl]propan-2-ol (CID 82423770) is 2-[2-[2-(2-methylphenoxy)ethyl]-1,3-thiazol-5-yl]propan-2-ol.
What is the SMILES notation for 2-[2-[2-(2-methylphenoxy)ethyl]-1,3-thiazol-5-yl]propan-2-ol?
The canonical SMILES for 2-[2-[2-(2-methylphenoxy)ethyl]-1,3-thiazol-5-yl]propan-2-ol is Cc1ccccc1OCCc1ncc(C(C)(C)O)s1.
What is the InChIKey of 2-[2-[2-(2-methylphenoxy)ethyl]-1,3-thiazol-5-yl]propan-2-ol?
The InChIKey is UHOFYLSDYYNRHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO2S/c1-11-6-4-5-7-12(11)18-9-8-14-16-10-13(19-14)15(2,3)17/h4-7,10,17H,8-9H2,1-3H3.
What are the key properties of 2-[2-[2-(2-methylphenoxy)ethyl]-1,3-thiazol-5-yl]propan-2-ol?
2-[2-[2-(2-methylphenoxy)ethyl]-1,3-thiazol-5-yl]propan-2-ol has a molecular weight of 277.39 g/mol, XLogP of 3.30, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-(2-methylphenoxy)ethyl]-1,3-thiazol-5-yl]propan-2-ol is sourced from PubChem (CID 82423770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).