5-(azetidin-2-yl)-1,2-oxazol-3-one

C6H8N2O2 — CID 143295423

IUPAC5-(azetidin-2-yl)-1,2-oxazol-3-one
SMILESO=c1cc(C2CCN2)o[nH]1
InChIInChI=1S/C6H8N2O2/c9-6-3-5(10-8-6)4-1-2-7-4/h3-4,7H,1-2H2,(H,8,9)
InChIKeyHMJMUOAGRMFZTM-UHFFFAOYSA-N
MW140.14 g/mol
LogP0.00
Rot. Bonds1

About 5-(azetidin-2-yl)-1,2-oxazol-3-one

5-(azetidin-2-yl)-1,2-oxazol-3-one (PubChem CID 143295423) has the molecular formula C6H8N2O2 and a molecular weight of 140.14 g/mol. Its IUPAC name is 5-(azetidin-2-yl)-1,2-oxazol-3-one.

Molecular Properties

Compound Name5-(azetidin-2-yl)-1,2-oxazol-3-one
PubChem CID143295423
Molecular FormulaC6H8N2O2
Molecular Weight140.14 g/mol
Exact Mass140.06
IUPAC Name5-(azetidin-2-yl)-1,2-oxazol-3-one
SMILESO=c1cc(C2CCN2)o[nH]1
InChIInChI=1S/C6H8N2O2/c9-6-3-5(10-8-6)4-1-2-7-4/h3-4,7H,1-2H2,(H,8,9)
InChIKeyHMJMUOAGRMFZTM-UHFFFAOYSA-N
XLogP0.00
TPSA58.03 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.14
LogP ≤ 50.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 5-(azetidin-2-yl)-1,2-oxazol-3-one 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

5-cyclopentyl-1,2-oxazol-3-one
CID 45099074
5-[(2R,4R)-2-(difluoromethyl)piperidin-4-yl]-1,2-oxazol-3-one
CID 66732459
5-[(2R,4R)-2-(4-chlorophenyl)piperidin-4-yl]-1,2-oxazol-3-one
CID 66732573
5-[(2S,4S)-2-(2-methylpropyl)piperidin-4-yl]-1,2-oxazol-3-one
CID 46938041
5-[(2S,4S)-2-(2-methyltetrazol-5-yl)piperidin-4-yl]-1,2-oxazol-3-one
CID 46937638
5-[(2R,4R)-2-(4-methylsulfonylphenyl)piperidin-4-yl]-1,2-oxazol-3-one
CID 66731817
5-[(2R,4R)-2-(4-chloro-3-fluorophenyl)piperidin-4-yl]-1,2-oxazol-3-one
CID 66732362
5-[(2R,4R)-2-[(3,5-difluorophenyl)methyl]piperidin-4-yl]-1,2-oxazol-3-one
CID 66732779
5-[(2S,4R)-2-[(2,3,4,5,6-pentadeuteriophenyl)methyl]piperidin-4-yl]-1,2-oxazol-3-one
CID 87129192
acetic acid;5-[(2R,4S)-2-cyclohexylpiperidin-4-yl]-1,2-oxazol-3-one
CID 174645063
5-[(2R,4S)-2-(cyclohexyloxymethyl)piperidin-4-yl]-1,2-oxazol-3-one
CID 66732687
5-[(2S,4R)-2-(2-phenylethyl)piperidin-4-yl]-1,2-oxazol-3-one
CID 46938043

Frequently Asked Questions

What is the IUPAC name of 5-(azetidin-2-yl)-1,2-oxazol-3-one?
The IUPAC name of 5-(azetidin-2-yl)-1,2-oxazol-3-one (CID 143295423) is 5-(azetidin-2-yl)-1,2-oxazol-3-one.
What is the SMILES notation for 5-(azetidin-2-yl)-1,2-oxazol-3-one?
The canonical SMILES for 5-(azetidin-2-yl)-1,2-oxazol-3-one is O=c1cc(C2CCN2)o[nH]1.
What is the InChIKey of 5-(azetidin-2-yl)-1,2-oxazol-3-one?
The InChIKey is HMJMUOAGRMFZTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2O2/c9-6-3-5(10-8-6)4-1-2-7-4/h3-4,7H,1-2H2,(H,8,9).
What are the key properties of 5-(azetidin-2-yl)-1,2-oxazol-3-one?
5-(azetidin-2-yl)-1,2-oxazol-3-one has a molecular weight of 140.14 g/mol, XLogP of 0.00, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(azetidin-2-yl)-1,2-oxazol-3-one is sourced from PubChem (CID 143295423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).