[2-(2-ethoxy-3-methoxyphenyl)-1,3-thiazol-5-yl]methanol

C13H15NO3S — CID 82191248

IUPAC[2-(2-ethoxy-3-methoxyphenyl)-1,3-thiazol-5-yl]methanol
SMILESCCOc1c(OC)cccc1-c1ncc(CO)s1
InChIInChI=1S/C13H15NO3S/c1-3-17-12-10(5-4-6-11(12)16-2)13-14-7-9(8-15)18-13/h4-7,15H,3,8H2,1-2H3
InChIKeyXUZBQUONOAHXQZ-UHFFFAOYSA-N
MW265.33 g/mol
LogP2.71
Rot. Bonds5

About [2-(2-ethoxy-3-methoxyphenyl)-1,3-thiazol-5-yl]methanol

[2-(2-ethoxy-3-methoxyphenyl)-1,3-thiazol-5-yl]methanol (PubChem CID 82191248) has the molecular formula C13H15NO3S and a molecular weight of 265.33 g/mol. Its IUPAC name is [2-(2-ethoxy-3-methoxyphenyl)-1,3-thiazol-5-yl]methanol.

Molecular Properties

Compound Name[2-(2-ethoxy-3-methoxyphenyl)-1,3-thiazol-5-yl]methanol
PubChem CID82191248
Molecular FormulaC13H15NO3S
Molecular Weight265.33 g/mol
Exact Mass265.08
IUPAC Name[2-(2-ethoxy-3-methoxyphenyl)-1,3-thiazol-5-yl]methanol
SMILESCCOc1c(OC)cccc1-c1ncc(CO)s1
InChIInChI=1S/C13H15NO3S/c1-3-17-12-10(5-4-6-11(12)16-2)13-14-7-9(8-15)18-13/h4-7,15H,3,8H2,1-2H3
InChIKeyXUZBQUONOAHXQZ-UHFFFAOYSA-N
XLogP2.71
TPSA51.58 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.33
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[2-(2-ethoxy-3-methoxyphenyl)-4-(methoxymethyl)-1,3-thiazol-5-yl]methanol
CID 82441264
2-[2-(2-ethoxy-3-methoxyphenyl)-4-methyl-1,3-thiazol-5-yl]propan-2-ol
CID 82427169
2-(2-ethoxy-3-methoxyphenyl)-1,3-benzothiazole
CID 16766166
2-(2-ethoxy-3-methoxyphenyl)-4-ethyl-1,3-thiazole-5-carboxylic acid
CID 20991959
2-[2-(2-ethoxy-3-methoxyphenyl)-1,3-thiazol-4-yl]propan-2-amine
CID 82515948
[2-(2-ethoxy-3-methoxyphenyl)-4-(methoxymethyl)-1,3-thiazol-5-yl]methanamine
CID 82441266
1-[2-(2-ethoxy-3-methoxyphenyl)-4-ethyl-1,3-thiazol-5-yl]-N-methylmethanamine
CID 82430165
[3-methoxy-2-[(2-methyl-1,3-thiazol-5-yl)methoxy]phenyl]methanol
CID 63021172
3-[2-(2-methoxyphenyl)-1,3-thiazol-5-yl]propanoic acid
CID 82303207
3-[2-(2-methoxyphenyl)-1,3-thiazol-5-yl]propan-1-amine
CID 115091894
ethyl 5-(2-ethoxy-3-methoxyphenyl)-2H-triazole-4-carboxylate
CID 169399469
5-ethoxy-2-naphthalen-1-yl-1,3-thiazole
CID 57148590

Frequently Asked Questions

What is the IUPAC name of [2-(2-ethoxy-3-methoxyphenyl)-1,3-thiazol-5-yl]methanol?
The IUPAC name of [2-(2-ethoxy-3-methoxyphenyl)-1,3-thiazol-5-yl]methanol (CID 82191248) is [2-(2-ethoxy-3-methoxyphenyl)-1,3-thiazol-5-yl]methanol.
What is the SMILES notation for [2-(2-ethoxy-3-methoxyphenyl)-1,3-thiazol-5-yl]methanol?
The canonical SMILES for [2-(2-ethoxy-3-methoxyphenyl)-1,3-thiazol-5-yl]methanol is CCOc1c(OC)cccc1-c1ncc(CO)s1.
What is the InChIKey of [2-(2-ethoxy-3-methoxyphenyl)-1,3-thiazol-5-yl]methanol?
The InChIKey is XUZBQUONOAHXQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO3S/c1-3-17-12-10(5-4-6-11(12)16-2)13-14-7-9(8-15)18-13/h4-7,15H,3,8H2,1-2H3.
What are the key properties of [2-(2-ethoxy-3-methoxyphenyl)-1,3-thiazol-5-yl]methanol?
[2-(2-ethoxy-3-methoxyphenyl)-1,3-thiazol-5-yl]methanol has a molecular weight of 265.33 g/mol, XLogP of 2.71, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-ethoxy-3-methoxyphenyl)-1,3-thiazol-5-yl]methanol is sourced from PubChem (CID 82191248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).