1-(2-hydrazinyl-2-oxoacetyl)-N-methylpiperidine-4-carboxamide

C9H16N4O3 — CID 61440353

IUPAC1-(2-hydrazinyl-2-oxoacetyl)-N-methylpiperidine-4-carboxamide
SMILESCNC(=O)C1CCN(C(=O)C(=O)NN)CC1
InChIInChI=1S/C9H16N4O3/c1-11-7(14)6-2-4-13(5-3-6)9(16)8(15)12-10/h6H,2-5,10H2,1H3,(H,11,14)(H,12,15)
InChIKeyODWIEZXYCOAVKG-UHFFFAOYSA-N
MW228.25 g/mol
LogP-2.04
Rot. Bonds1

About 1-(2-hydrazinyl-2-oxoacetyl)-N-methylpiperidine-4-carboxamide

1-(2-hydrazinyl-2-oxoacetyl)-N-methylpiperidine-4-carboxamide (PubChem CID 61440353) has the molecular formula C9H16N4O3 and a molecular weight of 228.25 g/mol. Its IUPAC name is 1-(2-hydrazinyl-2-oxoacetyl)-N-methylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-(2-hydrazinyl-2-oxoacetyl)-N-methylpiperidine-4-carboxamide
PubChem CID61440353
Molecular FormulaC9H16N4O3
Molecular Weight228.25 g/mol
Exact Mass228.12
IUPAC Name1-(2-hydrazinyl-2-oxoacetyl)-N-methylpiperidine-4-carboxamide
SMILESCNC(=O)C1CCN(C(=O)C(=O)NN)CC1
InChIInChI=1S/C9H16N4O3/c1-11-7(14)6-2-4-13(5-3-6)9(16)8(15)12-10/h6H,2-5,10H2,1H3,(H,11,14)(H,12,15)
InChIKeyODWIEZXYCOAVKG-UHFFFAOYSA-N
XLogP-2.04
TPSA104.53 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.25
LogP ≤ 5-2.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 1-(2-hydrazinyl-2-oxoacetyl)-N-methylpiperidine-4-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 1-(2-hydrazinyl-2-oxoacetyl)-N-methylpiperidine-4-carboxamide?
The IUPAC name of 1-(2-hydrazinyl-2-oxoacetyl)-N-methylpiperidine-4-carboxamide (CID 61440353) is 1-(2-hydrazinyl-2-oxoacetyl)-N-methylpiperidine-4-carboxamide.
What is the SMILES notation for 1-(2-hydrazinyl-2-oxoacetyl)-N-methylpiperidine-4-carboxamide?
The canonical SMILES for 1-(2-hydrazinyl-2-oxoacetyl)-N-methylpiperidine-4-carboxamide is CNC(=O)C1CCN(C(=O)C(=O)NN)CC1.
What is the InChIKey of 1-(2-hydrazinyl-2-oxoacetyl)-N-methylpiperidine-4-carboxamide?
The InChIKey is ODWIEZXYCOAVKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4O3/c1-11-7(14)6-2-4-13(5-3-6)9(16)8(15)12-10/h6H,2-5,10H2,1H3,(H,11,14)(H,12,15).
What are the key properties of 1-(2-hydrazinyl-2-oxoacetyl)-N-methylpiperidine-4-carboxamide?
1-(2-hydrazinyl-2-oxoacetyl)-N-methylpiperidine-4-carboxamide has a molecular weight of 228.25 g/mol, XLogP of -2.04, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-hydrazinyl-2-oxoacetyl)-N-methylpiperidine-4-carboxamide is sourced from PubChem (CID 61440353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).