2-[(2-propan-2-yl-1,3-thiazol-4-yl)methoxy]phenol

C13H15NO2S — CID 54956266

IUPAC2-[(2-propan-2-yl-1,3-thiazol-4-yl)methoxy]phenol
SMILESCC(C)c1nc(COc2ccccc2O)cs1
InChIInChI=1S/C13H15NO2S/c1-9(2)13-14-10(8-17-13)7-16-12-6-4-3-5-11(12)15/h3-6,8-9,15H,7H2,1-2H3
InChIKeyCDJYURVUILBUAA-UHFFFAOYSA-N
MW249.33 g/mol
LogP3.55
Rot. Bonds4

About 2-[(2-propan-2-yl-1,3-thiazol-4-yl)methoxy]phenol

2-[(2-propan-2-yl-1,3-thiazol-4-yl)methoxy]phenol (PubChem CID 54956266) has the molecular formula C13H15NO2S and a molecular weight of 249.33 g/mol. Its IUPAC name is 2-[(2-propan-2-yl-1,3-thiazol-4-yl)methoxy]phenol.

Molecular Properties

Compound Name2-[(2-propan-2-yl-1,3-thiazol-4-yl)methoxy]phenol
PubChem CID54956266
Molecular FormulaC13H15NO2S
Molecular Weight249.33 g/mol
Exact Mass249.08
IUPAC Name2-[(2-propan-2-yl-1,3-thiazol-4-yl)methoxy]phenol
SMILESCC(C)c1nc(COc2ccccc2O)cs1
InChIInChI=1S/C13H15NO2S/c1-9(2)13-14-10(8-17-13)7-16-12-6-4-3-5-11(12)15/h3-6,8-9,15H,7H2,1-2H3
InChIKeyCDJYURVUILBUAA-UHFFFAOYSA-N
XLogP3.55
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.33
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[(2-propan-2-yl-1,3-thiazol-4-yl)methoxy]phenol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[2-[(2-propan-2-yl-1,3-thiazol-4-yl)methoxy]phenyl]methanamine
CID 54956681
1-[2-[(2-propan-2-yl-1,3-thiazol-4-yl)methoxy]phenyl]ethanone
CID 61227732
2-[2-[(2-propan-2-yl-1,3-thiazol-4-yl)methoxy]phenyl]ethanol
CID 107258145
2-[(2-propan-2-yl-1,3-thiazol-4-yl)methoxy]benzamide
CID 38866514
(1S)-1-[2-[(2-propan-2-yl-1,3-thiazol-4-yl)methoxy]phenyl]propan-1-ol
CID 63364149
1-[2-[(2-propan-2-yl-1,3-thiazol-4-yl)methoxy]phenyl]propan-1-amine
CID 61487826
(1R)-1-[4-[(2-propan-2-yl-1,3-thiazol-4-yl)methoxy]phenyl]ethanol
CID 63364376
4-[(4-bromo-2-methylphenoxy)methyl]-2-propan-2-yl-1,3-thiazole
CID 63530798
3-[(2-propan-2-yl-1,3-thiazol-4-yl)methoxy]pyridine-4-carboxylic acid
CID 81446500
4-[(2-bromo-4-methoxyphenoxy)methyl]-2-propan-2-yl-1,3-thiazole
CID 104704731
1-[4-fluoro-2-[(2-propan-2-yl-1,3-thiazol-4-yl)methoxy]phenyl]-N-methylethanamine
CID 63064444
[5-[(2-propan-2-yl-1,3-thiazol-4-yl)methoxy]-2-pyridinyl]methanol
CID 79799349

Frequently Asked Questions

What is the IUPAC name of 2-[(2-propan-2-yl-1,3-thiazol-4-yl)methoxy]phenol?
The IUPAC name of 2-[(2-propan-2-yl-1,3-thiazol-4-yl)methoxy]phenol (CID 54956266) is 2-[(2-propan-2-yl-1,3-thiazol-4-yl)methoxy]phenol.
What is the SMILES notation for 2-[(2-propan-2-yl-1,3-thiazol-4-yl)methoxy]phenol?
The canonical SMILES for 2-[(2-propan-2-yl-1,3-thiazol-4-yl)methoxy]phenol is CC(C)c1nc(COc2ccccc2O)cs1.
What is the InChIKey of 2-[(2-propan-2-yl-1,3-thiazol-4-yl)methoxy]phenol?
The InChIKey is CDJYURVUILBUAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO2S/c1-9(2)13-14-10(8-17-13)7-16-12-6-4-3-5-11(12)15/h3-6,8-9,15H,7H2,1-2H3.
What are the key properties of 2-[(2-propan-2-yl-1,3-thiazol-4-yl)methoxy]phenol?
2-[(2-propan-2-yl-1,3-thiazol-4-yl)methoxy]phenol has a molecular weight of 249.33 g/mol, XLogP of 3.55, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-propan-2-yl-1,3-thiazol-4-yl)methoxy]phenol is sourced from PubChem (CID 54956266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).