3-(2-oxopiperidin-1-yl)propanehydrazide

C8H15N3O2 — CID 13150940

IUPAC3-(2-oxopiperidin-1-yl)propanehydrazide
SMILESNNC(=O)CCN1CCCCC1=O
InChIInChI=1S/C8H15N3O2/c9-10-7(12)4-6-11-5-2-1-3-8(11)13/h1-6,9H2,(H,10,12)
InChIKeyOTHAPKADMUTASH-UHFFFAOYSA-N
MW185.23 g/mol
LogP-0.62
Rot. Bonds3

About 3-(2-oxopiperidin-1-yl)propanehydrazide

3-(2-oxopiperidin-1-yl)propanehydrazide (PubChem CID 13150940) has the molecular formula C8H15N3O2 and a molecular weight of 185.23 g/mol. Its IUPAC name is 3-(2-oxopiperidin-1-yl)propanehydrazide.

Molecular Properties

Compound Name3-(2-oxopiperidin-1-yl)propanehydrazide
PubChem CID13150940
Molecular FormulaC8H15N3O2
Molecular Weight185.23 g/mol
Exact Mass185.12
IUPAC Name3-(2-oxopiperidin-1-yl)propanehydrazide
SMILESNNC(=O)CCN1CCCCC1=O
InChIInChI=1S/C8H15N3O2/c9-10-7(12)4-6-11-5-2-1-3-8(11)13/h1-6,9H2,(H,10,12)
InChIKeyOTHAPKADMUTASH-UHFFFAOYSA-N
XLogP-0.62
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.23
LogP ≤ 5-0.62
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'}

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Related Compounds

3-(Piperidin-1-yl)propanehydrazide
CID 776458
1-(2,2,2-Trifluoroacetyl)piperidine-3-carbohydrazide
CID 82275209
2-(2-Oxopiperidin-1-yl)acetohydrazide
CID 13150938
3-(2,6-Dioxopiperidin-1-yl)propanehydrazide
CID 23136080
3-(1-Methylpiperidin-1-ium-1-yl)propanehydrazide
CID 23136137
1-Acetylpiperidine-3-carbohydrazide
CID 25190936
N'-acetyl-1-methylpiperidine-3-carbohydrazide
CID 59556463
3-(Hydrazinecarbonyl)piperidine-1-carboxylic acid
CID 66651055
(3S)-3-(hydrazinecarbonyl)piperidine-1-carboxylic acid
CID 68651500
4-Hydrazinylpiperidin-2-one
CID 73185444
3-Oxo-3-piperidin-1-ylpropanehydrazide
CID 90180639
N'-methyl-2-(2-oxopiperidin-1-yl)acetohydrazide
CID 117801694

Frequently Asked Questions

What is the IUPAC name of 3-(2-oxopiperidin-1-yl)propanehydrazide?
The IUPAC name of 3-(2-oxopiperidin-1-yl)propanehydrazide (CID 13150940) is 3-(2-oxopiperidin-1-yl)propanehydrazide.
What is the SMILES notation for 3-(2-oxopiperidin-1-yl)propanehydrazide?
The canonical SMILES for 3-(2-oxopiperidin-1-yl)propanehydrazide is NNC(=O)CCN1CCCCC1=O.
What is the InChIKey of 3-(2-oxopiperidin-1-yl)propanehydrazide?
The InChIKey is OTHAPKADMUTASH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3O2/c9-10-7(12)4-6-11-5-2-1-3-8(11)13/h1-6,9H2,(H,10,12).
What are the key properties of 3-(2-oxopiperidin-1-yl)propanehydrazide?
3-(2-oxopiperidin-1-yl)propanehydrazide has a molecular weight of 185.23 g/mol, XLogP of -0.62, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-oxopiperidin-1-yl)propanehydrazide is sourced from PubChem (CID 13150940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).