3-hydroxy-3-(1,2-thiazol-5-yl)azetidine-1-carboxylic acid

C7H8N2O3S — CID 154081908

IUPAC3-hydroxy-3-(1,2-thiazol-5-yl)azetidine-1-carboxylic acid
SMILESO=C(O)N1CC(O)(c2ccns2)C1
InChIInChI=1S/C7H8N2O3S/c10-6(11)9-3-7(12,4-9)5-1-2-8-13-5/h1-2,12H,3-4H2,(H,10,11)
InChIKeyGYIAIHXGQUBNJF-UHFFFAOYSA-N
MW200.22 g/mol
LogP0.32
Rot. Bonds1

About 3-hydroxy-3-(1,2-thiazol-5-yl)azetidine-1-carboxylic acid

3-hydroxy-3-(1,2-thiazol-5-yl)azetidine-1-carboxylic acid (PubChem CID 154081908) has the molecular formula C7H8N2O3S and a molecular weight of 200.22 g/mol. Its IUPAC name is 3-hydroxy-3-(1,2-thiazol-5-yl)azetidine-1-carboxylic acid.

Molecular Properties

Compound Name3-hydroxy-3-(1,2-thiazol-5-yl)azetidine-1-carboxylic acid
PubChem CID154081908
Molecular FormulaC7H8N2O3S
Molecular Weight200.22 g/mol
Exact Mass200.03
IUPAC Name3-hydroxy-3-(1,2-thiazol-5-yl)azetidine-1-carboxylic acid
SMILESO=C(O)N1CC(O)(c2ccns2)C1
InChIInChI=1S/C7H8N2O3S/c10-6(11)9-3-7(12,4-9)5-1-2-8-13-5/h1-2,12H,3-4H2,(H,10,11)
InChIKeyGYIAIHXGQUBNJF-UHFFFAOYSA-N
XLogP0.32
TPSA73.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.22
LogP ≤ 50.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-hydroxy-3-(1,2-thiazol-5-yl)azetidine-1-carboxylic acid 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

1,1-Dimethylethyl 3-hydroxy-3-(5-isothiazolyl)-1-azetidinecarboxylate
CID 70166226
3-(1,2-Thiazol-5-yl)azetidin-3-ol
CID 131220900
1-Tert-butyl-3-(1,2-thiazol-5-yl)azetidin-3-ol
CID 164764062

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-3-(1,2-thiazol-5-yl)azetidine-1-carboxylic acid?
The IUPAC name of 3-hydroxy-3-(1,2-thiazol-5-yl)azetidine-1-carboxylic acid (CID 154081908) is 3-hydroxy-3-(1,2-thiazol-5-yl)azetidine-1-carboxylic acid.
What is the SMILES notation for 3-hydroxy-3-(1,2-thiazol-5-yl)azetidine-1-carboxylic acid?
The canonical SMILES for 3-hydroxy-3-(1,2-thiazol-5-yl)azetidine-1-carboxylic acid is O=C(O)N1CC(O)(c2ccns2)C1.
What is the InChIKey of 3-hydroxy-3-(1,2-thiazol-5-yl)azetidine-1-carboxylic acid?
The InChIKey is GYIAIHXGQUBNJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N2O3S/c10-6(11)9-3-7(12,4-9)5-1-2-8-13-5/h1-2,12H,3-4H2,(H,10,11).
What are the key properties of 3-hydroxy-3-(1,2-thiazol-5-yl)azetidine-1-carboxylic acid?
3-hydroxy-3-(1,2-thiazol-5-yl)azetidine-1-carboxylic acid has a molecular weight of 200.22 g/mol, XLogP of 0.32, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-3-(1,2-thiazol-5-yl)azetidine-1-carboxylic acid is sourced from PubChem (CID 154081908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).