[2-[(2-ethylphenoxy)methyl]-1,3-thiazol-5-yl]methanol

C13H15NO2S — CID 82190907

IUPAC[2-[(2-ethylphenoxy)methyl]-1,3-thiazol-5-yl]methanol
SMILESCCc1ccccc1OCc1ncc(CO)s1
InChIInChI=1S/C13H15NO2S/c1-2-10-5-3-4-6-12(10)16-9-13-14-7-11(8-15)17-13/h3-7,15H,2,8-9H2,1H3
InChIKeyMOPKEPXHLXDRKT-UHFFFAOYSA-N
MW249.33 g/mol
LogP2.78
Rot. Bonds5

About [2-[(2-ethylphenoxy)methyl]-1,3-thiazol-5-yl]methanol

[2-[(2-ethylphenoxy)methyl]-1,3-thiazol-5-yl]methanol (PubChem CID 82190907) has the molecular formula C13H15NO2S and a molecular weight of 249.33 g/mol. Its IUPAC name is [2-[(2-ethylphenoxy)methyl]-1,3-thiazol-5-yl]methanol.

Molecular Properties

Compound Name[2-[(2-ethylphenoxy)methyl]-1,3-thiazol-5-yl]methanol
PubChem CID82190907
Molecular FormulaC13H15NO2S
Molecular Weight249.33 g/mol
Exact Mass249.08
IUPAC Name[2-[(2-ethylphenoxy)methyl]-1,3-thiazol-5-yl]methanol
SMILESCCc1ccccc1OCc1ncc(CO)s1
InChIInChI=1S/C13H15NO2S/c1-2-10-5-3-4-6-12(10)16-9-13-14-7-11(8-15)17-13/h3-7,15H,2,8-9H2,1H3
InChIKeyMOPKEPXHLXDRKT-UHFFFAOYSA-N
XLogP2.78
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.33
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [2-[(2-ethylphenoxy)methyl]-1,3-thiazol-5-yl]methanol 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-methylphenoxy)methyl]-1,3-thiazol-5-yl]methanol
CID 82190879
2-[(2-ethylphenoxy)methyl]-1,3-thiazole-5-carbohydrazide
CID 82422860
N-[[2-[(2-chlorophenoxy)methyl]-1,3-thiazol-5-yl]methyl]ethanamine
CID 82190967
N-[[2-[2-(2-ethylphenoxy)ethyl]-1,3-thiazol-5-yl]methyl]propan-1-amine
CID 82423840
[2-[(4-chlorophenoxy)methyl]-1,3-thiazol-5-yl]methanol
CID 82190969
[2-[[2-(propylamino)-1,3-thiazol-5-yl]methoxy]phenyl]methanol
CID 79775065
2-[(2-ethylphenoxy)methyl]benzoic acid
CID 20987953
4-[(2-ethylphenoxy)methyl]-1,2-oxazole
CID 61223505
[2-[(2-chlorophenoxy)methyl]-1,3-thiazol-5-yl]methanamine
CID 82298972
[2-[[5-(ethylamino)-1,3,4-thiadiazol-2-yl]methoxy]phenyl]methanol
CID 80613528
N-[[2-[(2-methylphenoxy)methyl]-1,3-thiazol-5-yl]methyl]propan-1-amine
CID 82422739
2-[2-[(2,6-dimethylphenoxy)methyl]-1,3-thiazol-5-yl]acetic acid
CID 82422966

Frequently Asked Questions

What is the IUPAC name of [2-[(2-ethylphenoxy)methyl]-1,3-thiazol-5-yl]methanol?
The IUPAC name of [2-[(2-ethylphenoxy)methyl]-1,3-thiazol-5-yl]methanol (CID 82190907) is [2-[(2-ethylphenoxy)methyl]-1,3-thiazol-5-yl]methanol.
What is the SMILES notation for [2-[(2-ethylphenoxy)methyl]-1,3-thiazol-5-yl]methanol?
The canonical SMILES for [2-[(2-ethylphenoxy)methyl]-1,3-thiazol-5-yl]methanol is CCc1ccccc1OCc1ncc(CO)s1.
What is the InChIKey of [2-[(2-ethylphenoxy)methyl]-1,3-thiazol-5-yl]methanol?
The InChIKey is MOPKEPXHLXDRKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO2S/c1-2-10-5-3-4-6-12(10)16-9-13-14-7-11(8-15)17-13/h3-7,15H,2,8-9H2,1H3.
What are the key properties of [2-[(2-ethylphenoxy)methyl]-1,3-thiazol-5-yl]methanol?
[2-[(2-ethylphenoxy)methyl]-1,3-thiazol-5-yl]methanol has a molecular weight of 249.33 g/mol, XLogP of 2.78, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(2-ethylphenoxy)methyl]-1,3-thiazol-5-yl]methanol is sourced from PubChem (CID 82190907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).