5-ethyl-1-piperidin-4-ylpyrazolidin-3-one

C10H19N3O — CID 137367780

IUPAC5-ethyl-1-piperidin-4-ylpyrazolidin-3-one
SMILESCCC1CC(=O)NN1C1CCNCC1
InChIInChI=1S/C10H19N3O/c1-2-8-7-10(14)12-13(8)9-3-5-11-6-4-9/h8-9,11H,2-7H2,1H3,(H,12,14)
InChIKeyCXGWXBXMNGGLOR-UHFFFAOYSA-N
MW197.28 g/mol
LogP0.25
Rot. Bonds2

About 5-ethyl-1-piperidin-4-ylpyrazolidin-3-one

5-ethyl-1-piperidin-4-ylpyrazolidin-3-one (PubChem CID 137367780) has the molecular formula C10H19N3O and a molecular weight of 197.28 g/mol. Its IUPAC name is 5-ethyl-1-piperidin-4-ylpyrazolidin-3-one.

Molecular Properties

Compound Name5-ethyl-1-piperidin-4-ylpyrazolidin-3-one
PubChem CID137367780
Molecular FormulaC10H19N3O
Molecular Weight197.28 g/mol
Exact Mass197.15
IUPAC Name5-ethyl-1-piperidin-4-ylpyrazolidin-3-one
SMILESCCC1CC(=O)NN1C1CCNCC1
InChIInChI=1S/C10H19N3O/c1-2-8-7-10(14)12-13(8)9-3-5-11-6-4-9/h8-9,11H,2-7H2,1H3,(H,12,14)
InChIKeyCXGWXBXMNGGLOR-UHFFFAOYSA-N
XLogP0.25
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 50.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 5-ethyl-1-piperidin-4-ylpyrazolidin-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 5-ethyl-1-piperidin-4-ylpyrazolidin-3-one?
The IUPAC name of 5-ethyl-1-piperidin-4-ylpyrazolidin-3-one (CID 137367780) is 5-ethyl-1-piperidin-4-ylpyrazolidin-3-one.
What is the SMILES notation for 5-ethyl-1-piperidin-4-ylpyrazolidin-3-one?
The canonical SMILES for 5-ethyl-1-piperidin-4-ylpyrazolidin-3-one is CCC1CC(=O)NN1C1CCNCC1.
What is the InChIKey of 5-ethyl-1-piperidin-4-ylpyrazolidin-3-one?
The InChIKey is CXGWXBXMNGGLOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O/c1-2-8-7-10(14)12-13(8)9-3-5-11-6-4-9/h8-9,11H,2-7H2,1H3,(H,12,14).
What are the key properties of 5-ethyl-1-piperidin-4-ylpyrazolidin-3-one?
5-ethyl-1-piperidin-4-ylpyrazolidin-3-one has a molecular weight of 197.28 g/mol, XLogP of 0.25, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-1-piperidin-4-ylpyrazolidin-3-one is sourced from PubChem (CID 137367780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).