(6S)-6-pyrrolidin-1-yl-5,6,7,7a-tetrahydro-1H-pyrrolo[1,2-c][1,3]oxazol-3-one

C10H16N2O2 — CID 16639136

IUPAC(6S)-6-pyrrolidin-1-yl-5,6,7,7a-tetrahydro-1H-pyrrolo[1,2-c][1,3]oxazol-3-one
SMILESO=C1OCC2C[C@H](N3CCCC3)CN12
InChIInChI=1S/C10H16N2O2/c13-10-12-6-8(5-9(12)7-14-10)11-3-1-2-4-11/h8-9H,1-7H2/t8-,9?/m0/s1
InChIKeyUNLSJKFEFKDSDW-IENPIDJESA-N
MW196.25 g/mol
LogP0.68
Rot. Bonds1

About (6S)-6-pyrrolidin-1-yl-5,6,7,7a-tetrahydro-1H-pyrrolo[1,2-c][1,3]oxazol-3-one

(6S)-6-pyrrolidin-1-yl-5,6,7,7a-tetrahydro-1H-pyrrolo[1,2-c][1,3]oxazol-3-one (PubChem CID 16639136) has the molecular formula C10H16N2O2 and a molecular weight of 196.25 g/mol. Its IUPAC name is (6S)-6-pyrrolidin-1-yl-5,6,7,7a-tetrahydro-1H-pyrrolo[1,2-c][1,3]oxazol-3-one.

Molecular Properties

Compound Name(6S)-6-pyrrolidin-1-yl-5,6,7,7a-tetrahydro-1H-pyrrolo[1,2-c][1,3]oxazol-3-one
PubChem CID16639136
Molecular FormulaC10H16N2O2
Molecular Weight196.25 g/mol
Exact Mass196.12
IUPAC Name(6S)-6-pyrrolidin-1-yl-5,6,7,7a-tetrahydro-1H-pyrrolo[1,2-c][1,3]oxazol-3-one
SMILESO=C1OCC2C[C@H](N3CCCC3)CN12
InChIInChI=1S/C10H16N2O2/c13-10-12-6-8(5-9(12)7-14-10)11-3-1-2-4-11/h8-9H,1-7H2/t8-,9?/m0/s1
InChIKeyUNLSJKFEFKDSDW-IENPIDJESA-N
XLogP0.68
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 50.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze (6S)-6-pyrrolidin-1-yl-5,6,7,7a-tetrahydro-1H-pyrrolo[1,2-c][1,3]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

Frequently Asked Questions

What is the IUPAC name of (6S)-6-pyrrolidin-1-yl-5,6,7,7a-tetrahydro-1H-pyrrolo[1,2-c][1,3]oxazol-3-one?
The IUPAC name of (6S)-6-pyrrolidin-1-yl-5,6,7,7a-tetrahydro-1H-pyrrolo[1,2-c][1,3]oxazol-3-one (CID 16639136) is (6S)-6-pyrrolidin-1-yl-5,6,7,7a-tetrahydro-1H-pyrrolo[1,2-c][1,3]oxazol-3-one.
What is the SMILES notation for (6S)-6-pyrrolidin-1-yl-5,6,7,7a-tetrahydro-1H-pyrrolo[1,2-c][1,3]oxazol-3-one?
The canonical SMILES for (6S)-6-pyrrolidin-1-yl-5,6,7,7a-tetrahydro-1H-pyrrolo[1,2-c][1,3]oxazol-3-one is O=C1OCC2C[C@H](N3CCCC3)CN12.
What is the InChIKey of (6S)-6-pyrrolidin-1-yl-5,6,7,7a-tetrahydro-1H-pyrrolo[1,2-c][1,3]oxazol-3-one?
The InChIKey is UNLSJKFEFKDSDW-IENPIDJESA-N. The full InChI is InChI=1S/C10H16N2O2/c13-10-12-6-8(5-9(12)7-14-10)11-3-1-2-4-11/h8-9H,1-7H2/t8-,9?/m0/s1.
What are the key properties of (6S)-6-pyrrolidin-1-yl-5,6,7,7a-tetrahydro-1H-pyrrolo[1,2-c][1,3]oxazol-3-one?
(6S)-6-pyrrolidin-1-yl-5,6,7,7a-tetrahydro-1H-pyrrolo[1,2-c][1,3]oxazol-3-one has a molecular weight of 196.25 g/mol, XLogP of 0.68, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6S)-6-pyrrolidin-1-yl-5,6,7,7a-tetrahydro-1H-pyrrolo[1,2-c][1,3]oxazol-3-one is sourced from PubChem (CID 16639136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).