4-(3-hydrazinyl-3-oxopropanoyl)piperazine-1-carboxamide

C8H15N5O3 — CID 2759285

IUPAC4-(3-hydrazinyl-3-oxopropanoyl)piperazine-1-carboxamide
SMILESNNC(=O)CC(=O)N1CCN(C(N)=O)CC1
InChIInChI=1S/C8H15N5O3/c9-8(16)13-3-1-12(2-4-13)7(15)5-6(14)11-10/h1-5,10H2,(H2,9,16)(H,11,14)
InChIKeyWVWBQXZCAFEEIL-UHFFFAOYSA-N
MW229.24 g/mol
LogP-2.41
Rot. Bonds2

About 4-(3-hydrazinyl-3-oxopropanoyl)piperazine-1-carboxamide

4-(3-hydrazinyl-3-oxopropanoyl)piperazine-1-carboxamide (PubChem CID 2759285) has the molecular formula C8H15N5O3 and a molecular weight of 229.24 g/mol. Its IUPAC name is 4-(3-hydrazinyl-3-oxopropanoyl)piperazine-1-carboxamide.

Molecular Properties

Compound Name4-(3-hydrazinyl-3-oxopropanoyl)piperazine-1-carboxamide
PubChem CID2759285
Molecular FormulaC8H15N5O3
Molecular Weight229.24 g/mol
Exact Mass229.12
IUPAC Name4-(3-hydrazinyl-3-oxopropanoyl)piperazine-1-carboxamide
SMILESNNC(=O)CC(=O)N1CCN(C(N)=O)CC1
InChIInChI=1S/C8H15N5O3/c9-8(16)13-3-1-12(2-4-13)7(15)5-6(14)11-10/h1-5,10H2,(H2,9,16)(H,11,14)
InChIKeyWVWBQXZCAFEEIL-UHFFFAOYSA-N
XLogP-2.41
TPSA121.76 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.24
LogP ≤ 5-2.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 4-(3-hydrazinyl-3-oxopropanoyl)piperazine-1-carboxamide 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 4-(3-hydrazinyl-3-oxopropanoyl)piperazine-1-carboxamide?
The IUPAC name of 4-(3-hydrazinyl-3-oxopropanoyl)piperazine-1-carboxamide (CID 2759285) is 4-(3-hydrazinyl-3-oxopropanoyl)piperazine-1-carboxamide.
What is the SMILES notation for 4-(3-hydrazinyl-3-oxopropanoyl)piperazine-1-carboxamide?
The canonical SMILES for 4-(3-hydrazinyl-3-oxopropanoyl)piperazine-1-carboxamide is NNC(=O)CC(=O)N1CCN(C(N)=O)CC1.
What is the InChIKey of 4-(3-hydrazinyl-3-oxopropanoyl)piperazine-1-carboxamide?
The InChIKey is WVWBQXZCAFEEIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N5O3/c9-8(16)13-3-1-12(2-4-13)7(15)5-6(14)11-10/h1-5,10H2,(H2,9,16)(H,11,14).
What are the key properties of 4-(3-hydrazinyl-3-oxopropanoyl)piperazine-1-carboxamide?
4-(3-hydrazinyl-3-oxopropanoyl)piperazine-1-carboxamide has a molecular weight of 229.24 g/mol, XLogP of -2.41, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-hydrazinyl-3-oxopropanoyl)piperazine-1-carboxamide is sourced from PubChem (CID 2759285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).