(5S)-5-ethylpyrrolidin-2-one

C6H11NO — CID 59748000

IUPAC(5S)-5-ethylpyrrolidin-2-one
SMILESCC[C@H]1CCC(=O)N1
InChIInChI=1S/C6H11NO/c1-2-5-3-4-6(8)7-5/h5H,2-4H2,1H3,(H,7,8)/t5-/m0/s1
InChIKeyQMXPTUUFGSTIKK-YFKPBYRVSA-N
MW113.16 g/mol
LogP0.68
Rot. Bonds1

About (5S)-5-ethylpyrrolidin-2-one

(5S)-5-ethylpyrrolidin-2-one (PubChem CID 59748000) has the molecular formula C6H11NO and a molecular weight of 113.16 g/mol. Its IUPAC name is (5S)-5-ethylpyrrolidin-2-one.

Molecular Properties

Compound Name(5S)-5-ethylpyrrolidin-2-one
PubChem CID59748000
Molecular FormulaC6H11NO
Molecular Weight113.16 g/mol
Exact Mass113.08
IUPAC Name(5S)-5-ethylpyrrolidin-2-one
SMILESCC[C@H]1CCC(=O)N1
InChIInChI=1S/C6H11NO/c1-2-5-3-4-6(8)7-5/h5H,2-4H2,1H3,(H,7,8)/t5-/m0/s1
InChIKeyQMXPTUUFGSTIKK-YFKPBYRVSA-N
XLogP0.68
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.16
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze (5S)-5-ethylpyrrolidin-2-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 (5S)-5-ethylpyrrolidin-2-one?
The IUPAC name of (5S)-5-ethylpyrrolidin-2-one (CID 59748000) is (5S)-5-ethylpyrrolidin-2-one.
What is the SMILES notation for (5S)-5-ethylpyrrolidin-2-one?
The canonical SMILES for (5S)-5-ethylpyrrolidin-2-one is CC[C@H]1CCC(=O)N1.
What is the InChIKey of (5S)-5-ethylpyrrolidin-2-one?
The InChIKey is QMXPTUUFGSTIKK-YFKPBYRVSA-N. The full InChI is InChI=1S/C6H11NO/c1-2-5-3-4-6(8)7-5/h5H,2-4H2,1H3,(H,7,8)/t5-/m0/s1.
What are the key properties of (5S)-5-ethylpyrrolidin-2-one?
(5S)-5-ethylpyrrolidin-2-one has a molecular weight of 113.16 g/mol, XLogP of 0.68, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-5-ethylpyrrolidin-2-one is sourced from PubChem (CID 59748000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).