1-(4-hydroxy-1-oxo-1-piperidin-1-ylbutan-2-yl)pyrrolidin-2-one

C13H22N2O3 — CID 23342862

IUPAC1-(4-hydroxy-1-oxo-1-piperidin-1-ylbutan-2-yl)pyrrolidin-2-one
SMILESO=C(C(CCO)N1CCCC1=O)N1CCCCC1
InChIInChI=1S/C13H22N2O3/c16-10-6-11(15-9-4-5-12(15)17)13(18)14-7-2-1-3-8-14/h11,16H,1-10H2
InChIKeyAMNOQEWZRNHODF-UHFFFAOYSA-N
MW254.33 g/mol
LogP0.37
Rot. Bonds4

About 1-(4-hydroxy-1-oxo-1-piperidin-1-ylbutan-2-yl)pyrrolidin-2-one

1-(4-hydroxy-1-oxo-1-piperidin-1-ylbutan-2-yl)pyrrolidin-2-one (PubChem CID 23342862) has the molecular formula C13H22N2O3 and a molecular weight of 254.33 g/mol. Its IUPAC name is 1-(4-hydroxy-1-oxo-1-piperidin-1-ylbutan-2-yl)pyrrolidin-2-one.

Molecular Properties

Compound Name1-(4-hydroxy-1-oxo-1-piperidin-1-ylbutan-2-yl)pyrrolidin-2-one
PubChem CID23342862
Molecular FormulaC13H22N2O3
Molecular Weight254.33 g/mol
Exact Mass254.16
IUPAC Name1-(4-hydroxy-1-oxo-1-piperidin-1-ylbutan-2-yl)pyrrolidin-2-one
SMILESO=C(C(CCO)N1CCCC1=O)N1CCCCC1
InChIInChI=1S/C13H22N2O3/c16-10-6-11(15-9-4-5-12(15)17)13(18)14-7-2-1-3-8-14/h11,16H,1-10H2
InChIKeyAMNOQEWZRNHODF-UHFFFAOYSA-N
XLogP0.37
TPSA60.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 50.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(4-hydroxy-1-oxo-1-piperidin-1-ylbutan-2-yl)pyrrolidin-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 1-(4-hydroxy-1-oxo-1-piperidin-1-ylbutan-2-yl)pyrrolidin-2-one?
The IUPAC name of 1-(4-hydroxy-1-oxo-1-piperidin-1-ylbutan-2-yl)pyrrolidin-2-one (CID 23342862) is 1-(4-hydroxy-1-oxo-1-piperidin-1-ylbutan-2-yl)pyrrolidin-2-one.
What is the SMILES notation for 1-(4-hydroxy-1-oxo-1-piperidin-1-ylbutan-2-yl)pyrrolidin-2-one?
The canonical SMILES for 1-(4-hydroxy-1-oxo-1-piperidin-1-ylbutan-2-yl)pyrrolidin-2-one is O=C(C(CCO)N1CCCC1=O)N1CCCCC1.
What is the InChIKey of 1-(4-hydroxy-1-oxo-1-piperidin-1-ylbutan-2-yl)pyrrolidin-2-one?
The InChIKey is AMNOQEWZRNHODF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O3/c16-10-6-11(15-9-4-5-12(15)17)13(18)14-7-2-1-3-8-14/h11,16H,1-10H2.
What are the key properties of 1-(4-hydroxy-1-oxo-1-piperidin-1-ylbutan-2-yl)pyrrolidin-2-one?
1-(4-hydroxy-1-oxo-1-piperidin-1-ylbutan-2-yl)pyrrolidin-2-one has a molecular weight of 254.33 g/mol, XLogP of 0.37, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-hydroxy-1-oxo-1-piperidin-1-ylbutan-2-yl)pyrrolidin-2-one is sourced from PubChem (CID 23342862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).