4-(4-cyclopentylpiperazin-1-yl)-4-oxobutanehydrazide

C13H24N4O2 — CID 4740462

IUPAC4-(4-cyclopentylpiperazin-1-yl)-4-oxobutanehydrazide
SMILESNNC(=O)CCC(=O)N1CCN(C2CCCC2)CC1
InChIInChI=1S/C13H24N4O2/c14-15-12(18)5-6-13(19)17-9-7-16(8-10-17)11-3-1-2-4-11/h11H,1-10,14H2,(H,15,18)
InChIKeyOACSYUUCQMBLDH-UHFFFAOYSA-N
MW268.36 g/mol
LogP-0.16
Rot. Bonds4

About 4-(4-cyclopentylpiperazin-1-yl)-4-oxobutanehydrazide

4-(4-cyclopentylpiperazin-1-yl)-4-oxobutanehydrazide (PubChem CID 4740462) has the molecular formula C13H24N4O2 and a molecular weight of 268.36 g/mol. Its IUPAC name is 4-(4-cyclopentylpiperazin-1-yl)-4-oxobutanehydrazide.

Molecular Properties

Compound Name4-(4-cyclopentylpiperazin-1-yl)-4-oxobutanehydrazide
PubChem CID4740462
Molecular FormulaC13H24N4O2
Molecular Weight268.36 g/mol
Exact Mass268.19
IUPAC Name4-(4-cyclopentylpiperazin-1-yl)-4-oxobutanehydrazide
SMILESNNC(=O)CCC(=O)N1CCN(C2CCCC2)CC1
InChIInChI=1S/C13H24N4O2/c14-15-12(18)5-6-13(19)17-9-7-16(8-10-17)11-3-1-2-4-11/h11H,1-10,14H2,(H,15,18)
InChIKeyOACSYUUCQMBLDH-UHFFFAOYSA-N
XLogP-0.16
TPSA78.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 5-0.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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-(4-cyclopentylpiperazin-1-yl)-4-oxobutanehydrazide 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-(4-cyclopentylpiperazin-1-yl)-4-oxobutanehydrazide?
The IUPAC name of 4-(4-cyclopentylpiperazin-1-yl)-4-oxobutanehydrazide (CID 4740462) is 4-(4-cyclopentylpiperazin-1-yl)-4-oxobutanehydrazide.
What is the SMILES notation for 4-(4-cyclopentylpiperazin-1-yl)-4-oxobutanehydrazide?
The canonical SMILES for 4-(4-cyclopentylpiperazin-1-yl)-4-oxobutanehydrazide is NNC(=O)CCC(=O)N1CCN(C2CCCC2)CC1.
What is the InChIKey of 4-(4-cyclopentylpiperazin-1-yl)-4-oxobutanehydrazide?
The InChIKey is OACSYUUCQMBLDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4O2/c14-15-12(18)5-6-13(19)17-9-7-16(8-10-17)11-3-1-2-4-11/h11H,1-10,14H2,(H,15,18).
What are the key properties of 4-(4-cyclopentylpiperazin-1-yl)-4-oxobutanehydrazide?
4-(4-cyclopentylpiperazin-1-yl)-4-oxobutanehydrazide has a molecular weight of 268.36 g/mol, XLogP of -0.16, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-cyclopentylpiperazin-1-yl)-4-oxobutanehydrazide is sourced from PubChem (CID 4740462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).