2-[5-(hydroxymethyl)-2-methyl-1,3-thiazol-4-yl]ethanol

C7H11NO2S — CID 145485759

IUPAC2-[5-(hydroxymethyl)-2-methyl-1,3-thiazol-4-yl]ethanol
SMILESCc1nc(CCO)c(CO)s1
InChIInChI=1S/C7H11NO2S/c1-5-8-6(2-3-9)7(4-10)11-5/h9-10H,2-4H2,1H3
InChIKeyIUSVAPBSDYDPEW-UHFFFAOYSA-N
MW173.24 g/mol
LogP0.48
Rot. Bonds3

About 2-[5-(hydroxymethyl)-2-methyl-1,3-thiazol-4-yl]ethanol

2-[5-(hydroxymethyl)-2-methyl-1,3-thiazol-4-yl]ethanol (PubChem CID 145485759) has the molecular formula C7H11NO2S and a molecular weight of 173.24 g/mol. Its IUPAC name is 2-[5-(hydroxymethyl)-2-methyl-1,3-thiazol-4-yl]ethanol.

Molecular Properties

Compound Name2-[5-(hydroxymethyl)-2-methyl-1,3-thiazol-4-yl]ethanol
PubChem CID145485759
Molecular FormulaC7H11NO2S
Molecular Weight173.24 g/mol
Exact Mass173.05
IUPAC Name2-[5-(hydroxymethyl)-2-methyl-1,3-thiazol-4-yl]ethanol
SMILESCc1nc(CCO)c(CO)s1
InChIInChI=1S/C7H11NO2S/c1-5-8-6(2-3-9)7(4-10)11-5/h9-10H,2-4H2,1H3
InChIKeyIUSVAPBSDYDPEW-UHFFFAOYSA-N
XLogP0.48
TPSA53.35 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.24
LogP ≤ 50.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[5-(hydroxymethyl)-2-methyl-1,3-thiazol-4-yl]ethanol with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[5-(hydroxymethyl)-2-methyl-1,3-thiazol-4-yl]ethanol?
The IUPAC name of 2-[5-(hydroxymethyl)-2-methyl-1,3-thiazol-4-yl]ethanol (CID 145485759) is 2-[5-(hydroxymethyl)-2-methyl-1,3-thiazol-4-yl]ethanol.
What is the SMILES notation for 2-[5-(hydroxymethyl)-2-methyl-1,3-thiazol-4-yl]ethanol?
The canonical SMILES for 2-[5-(hydroxymethyl)-2-methyl-1,3-thiazol-4-yl]ethanol is Cc1nc(CCO)c(CO)s1.
What is the InChIKey of 2-[5-(hydroxymethyl)-2-methyl-1,3-thiazol-4-yl]ethanol?
The InChIKey is IUSVAPBSDYDPEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NO2S/c1-5-8-6(2-3-9)7(4-10)11-5/h9-10H,2-4H2,1H3.
What are the key properties of 2-[5-(hydroxymethyl)-2-methyl-1,3-thiazol-4-yl]ethanol?
2-[5-(hydroxymethyl)-2-methyl-1,3-thiazol-4-yl]ethanol has a molecular weight of 173.24 g/mol, XLogP of 0.48, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(hydroxymethyl)-2-methyl-1,3-thiazol-4-yl]ethanol is sourced from PubChem (CID 145485759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).