3-(1,3-thiazol-2-yl)oxetan-3-amine;hydrochloride

C6H9ClN2OS — CID 86674782

IUPAC3-(1,3-thiazol-2-yl)oxetan-3-amine;hydrochloride
SMILESCl.NC1(c2nccs2)COC1
InChIInChI=1S/C6H8N2OS.ClH/c7-6(3-9-4-6)5-8-1-2-10-5;/h1-2H,3-4,7H2;1H
InChIKeyZGZIUVDIBNRGES-UHFFFAOYSA-N
MW192.67 g/mol
LogP0.75
Rot. Bonds1

About 3-(1,3-thiazol-2-yl)oxetan-3-amine;hydrochloride

3-(1,3-thiazol-2-yl)oxetan-3-amine;hydrochloride (PubChem CID 86674782) has the molecular formula C6H9ClN2OS and a molecular weight of 192.67 g/mol. Its IUPAC name is 3-(1,3-thiazol-2-yl)oxetan-3-amine;hydrochloride.

Molecular Properties

Compound Name3-(1,3-thiazol-2-yl)oxetan-3-amine;hydrochloride
PubChem CID86674782
Molecular FormulaC6H9ClN2OS
Molecular Weight192.67 g/mol
Exact Mass192.01
IUPAC Name3-(1,3-thiazol-2-yl)oxetan-3-amine;hydrochloride
SMILESCl.NC1(c2nccs2)COC1
InChIInChI=1S/C6H8N2OS.ClH/c7-6(3-9-4-6)5-8-1-2-10-5;/h1-2H,3-4,7H2;1H
InChIKeyZGZIUVDIBNRGES-UHFFFAOYSA-N
XLogP0.75
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.67
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(1,3-thiazol-2-yl)oxetan-3-amine;hydrochloride 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 3-(1,3-thiazol-2-yl)oxetan-3-amine;hydrochloride?
The IUPAC name of 3-(1,3-thiazol-2-yl)oxetan-3-amine;hydrochloride (CID 86674782) is 3-(1,3-thiazol-2-yl)oxetan-3-amine;hydrochloride.
What is the SMILES notation for 3-(1,3-thiazol-2-yl)oxetan-3-amine;hydrochloride?
The canonical SMILES for 3-(1,3-thiazol-2-yl)oxetan-3-amine;hydrochloride is Cl.NC1(c2nccs2)COC1.
What is the InChIKey of 3-(1,3-thiazol-2-yl)oxetan-3-amine;hydrochloride?
The InChIKey is ZGZIUVDIBNRGES-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2OS.ClH/c7-6(3-9-4-6)5-8-1-2-10-5;/h1-2H,3-4,7H2;1H.
What are the key properties of 3-(1,3-thiazol-2-yl)oxetan-3-amine;hydrochloride?
3-(1,3-thiazol-2-yl)oxetan-3-amine;hydrochloride has a molecular weight of 192.67 g/mol, XLogP of 0.75, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1,3-thiazol-2-yl)oxetan-3-amine;hydrochloride is sourced from PubChem (CID 86674782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).