4-(2-oxopiperidin-1-yl)butanehydrazide

C9H17N3O2 — CID 13150941

IUPAC4-(2-oxopiperidin-1-yl)butanehydrazide
SMILESNNC(=O)CCCN1CCCCC1=O
InChIInChI=1S/C9H17N3O2/c10-11-8(13)4-3-7-12-6-2-1-5-9(12)14/h1-7,10H2,(H,11,13)
InChIKeyXKWUUZKAMKUJBQ-UHFFFAOYSA-N
MW199.25 g/mol
LogP-0.23
Rot. Bonds4

About 4-(2-oxopiperidin-1-yl)butanehydrazide

4-(2-oxopiperidin-1-yl)butanehydrazide (PubChem CID 13150941) has the molecular formula C9H17N3O2 and a molecular weight of 199.25 g/mol. Its IUPAC name is 4-(2-oxopiperidin-1-yl)butanehydrazide.

Molecular Properties

Compound Name4-(2-oxopiperidin-1-yl)butanehydrazide
PubChem CID13150941
Molecular FormulaC9H17N3O2
Molecular Weight199.25 g/mol
Exact Mass199.13
IUPAC Name4-(2-oxopiperidin-1-yl)butanehydrazide
SMILESNNC(=O)CCCN1CCCCC1=O
InChIInChI=1S/C9H17N3O2/c10-11-8(13)4-3-7-12-6-2-1-5-9(12)14/h1-7,10H2,(H,11,13)
InChIKeyXKWUUZKAMKUJBQ-UHFFFAOYSA-N
XLogP-0.23
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.25
LogP ≤ 5-0.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 4-(2-oxopiperidin-1-yl)butanehydrazide 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

1-Acetylpiperidine-4-carbohydrazide
CID 468609
N',N'dimethyl-4-piperidino-4-oxobutanoylhydrazinium iodide
CID 155907343
5-(3,3-Difluoropiperidin-1-yl)pentanehydrazide
CID 151147765
2-(2-Oxopiperidin-1-yl)acetohydrazide
CID 13150938
1-Pentyldiazinane-3,6-dione
CID 21443664
3-(2,6-Dioxopiperidin-1-yl)propanehydrazide
CID 23136080
1-(2-Methylpropanoyl)piperidine-4-carbohydrazide
CID 43244737
1-(2,2-Dimethylpropanoyl)piperidine-4-carbohydrazide
CID 54794053
3-Oxo-3-piperidin-1-ylpropanehydrazide
CID 90180639
N'-[2-(1-methylpiperidin-4-yl)acetyl]pentanehydrazide
CID 91577134
N'-methyl-2-(2-oxopiperidin-1-yl)acetohydrazide
CID 117801694
N-(2-Oxo-1-piperidinyl)acetamide
CID 127013701

Frequently Asked Questions

What is the IUPAC name of 4-(2-oxopiperidin-1-yl)butanehydrazide?
The IUPAC name of 4-(2-oxopiperidin-1-yl)butanehydrazide (CID 13150941) is 4-(2-oxopiperidin-1-yl)butanehydrazide.
What is the SMILES notation for 4-(2-oxopiperidin-1-yl)butanehydrazide?
The canonical SMILES for 4-(2-oxopiperidin-1-yl)butanehydrazide is NNC(=O)CCCN1CCCCC1=O.
What is the InChIKey of 4-(2-oxopiperidin-1-yl)butanehydrazide?
The InChIKey is XKWUUZKAMKUJBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3O2/c10-11-8(13)4-3-7-12-6-2-1-5-9(12)14/h1-7,10H2,(H,11,13).
What are the key properties of 4-(2-oxopiperidin-1-yl)butanehydrazide?
4-(2-oxopiperidin-1-yl)butanehydrazide has a molecular weight of 199.25 g/mol, XLogP of -0.23, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-oxopiperidin-1-yl)butanehydrazide is sourced from PubChem (CID 13150941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).