3-[(2S)-pyrrolidin-2-yl]-2H-1,2-oxazol-5-one

C7H10N2O2 — CID 83845605

IUPAC3-[(2S)-pyrrolidin-2-yl]-2H-1,2-oxazol-5-one
SMILESO=c1cc([C@@H]2CCCN2)[nH]o1
InChIInChI=1S/C7H10N2O2/c10-7-4-6(9-11-7)5-2-1-3-8-5/h4-5,8-9H,1-3H2/t5-/m0/s1
InChIKeyLWWSUPSPNGDSTL-YFKPBYRVSA-N
MW154.17 g/mol
LogP0.39
Rot. Bonds1

About 3-[(2S)-pyrrolidin-2-yl]-2H-1,2-oxazol-5-one

3-[(2S)-pyrrolidin-2-yl]-2H-1,2-oxazol-5-one (PubChem CID 83845605) has the molecular formula C7H10N2O2 and a molecular weight of 154.17 g/mol. Its IUPAC name is 3-[(2S)-pyrrolidin-2-yl]-2H-1,2-oxazol-5-one.

Molecular Properties

Compound Name3-[(2S)-pyrrolidin-2-yl]-2H-1,2-oxazol-5-one
PubChem CID83845605
Molecular FormulaC7H10N2O2
Molecular Weight154.17 g/mol
Exact Mass154.07
IUPAC Name3-[(2S)-pyrrolidin-2-yl]-2H-1,2-oxazol-5-one
SMILESO=c1cc([C@@H]2CCCN2)[nH]o1
InChIInChI=1S/C7H10N2O2/c10-7-4-6(9-11-7)5-2-1-3-8-5/h4-5,8-9H,1-3H2/t5-/m0/s1
InChIKeyLWWSUPSPNGDSTL-YFKPBYRVSA-N
XLogP0.39
TPSA58.03 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.17
LogP ≤ 50.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-[(2S)-pyrrolidin-2-yl]-2H-1,2-oxazol-5-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

4-methyl-3-pyrrolidin-2-yl-2H-1,2-oxazol-5-one
CID 130794068
2-methyl-6-[(2S)-pyrrolidin-2-yl]-1H-pyridin-4-one
CID 56838322
6-[(2R)-pyrrolidin-2-yl]chromen-2-one
CID 66518839
[5-[(2S)-pyrrolidin-2-yl]-3-pyridinyl]boronic acid
CID 124671778
2-methyl-3-[(2S)-pyrrolidin-2-yl]-1H-pyrazol-5-one
CID 83845962
5-pyrrolidin-2-yl-1H-pyrrol-2-ol
CID 130002366
2-methyl-5-[(2S)-pyrrolidin-2-yl]-1H-pyridin-4-one
CID 131137914
3-pyrrolidin-2-yl-1H-quinolin-2-one
CID 84621897
2-(2,5-dimethylfuran-3-yl)pyrrolidine
CID 54594405
2-(5-methylfuran-3-yl)pyrrolidine
CID 82594860
5-fluoro-3-[(2R)-pyrrolidin-2-yl]-1H-pyridin-2-one
CID 141424047
6-piperidin-2-yl-1H-pyrimidin-2-one
CID 83846397

Frequently Asked Questions

What is the IUPAC name of 3-[(2S)-pyrrolidin-2-yl]-2H-1,2-oxazol-5-one?
The IUPAC name of 3-[(2S)-pyrrolidin-2-yl]-2H-1,2-oxazol-5-one (CID 83845605) is 3-[(2S)-pyrrolidin-2-yl]-2H-1,2-oxazol-5-one.
What is the SMILES notation for 3-[(2S)-pyrrolidin-2-yl]-2H-1,2-oxazol-5-one?
The canonical SMILES for 3-[(2S)-pyrrolidin-2-yl]-2H-1,2-oxazol-5-one is O=c1cc([C@@H]2CCCN2)[nH]o1.
What is the InChIKey of 3-[(2S)-pyrrolidin-2-yl]-2H-1,2-oxazol-5-one?
The InChIKey is LWWSUPSPNGDSTL-YFKPBYRVSA-N. The full InChI is InChI=1S/C7H10N2O2/c10-7-4-6(9-11-7)5-2-1-3-8-5/h4-5,8-9H,1-3H2/t5-/m0/s1.
What are the key properties of 3-[(2S)-pyrrolidin-2-yl]-2H-1,2-oxazol-5-one?
3-[(2S)-pyrrolidin-2-yl]-2H-1,2-oxazol-5-one has a molecular weight of 154.17 g/mol, XLogP of 0.39, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2S)-pyrrolidin-2-yl]-2H-1,2-oxazol-5-one is sourced from PubChem (CID 83845605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).