4-(3-piperidin-1-ylpyrrolidin-1-yl)pentanehydrazide

C14H28N4O — CID 63584460

IUPAC4-(3-piperidin-1-ylpyrrolidin-1-yl)pentanehydrazide
SMILESCC(CCC(=O)NN)N1CCC(N2CCCCC2)C1
InChIInChI=1S/C14H28N4O/c1-12(5-6-14(19)16-15)18-10-7-13(11-18)17-8-3-2-4-9-17/h12-13H,2-11,15H2,1H3,(H,16,19)
InChIKeyVWEDPUUGALEOJZ-UHFFFAOYSA-N
MW268.40 g/mol
LogP0.71
Rot. Bonds5

About 4-(3-piperidin-1-ylpyrrolidin-1-yl)pentanehydrazide

4-(3-piperidin-1-ylpyrrolidin-1-yl)pentanehydrazide (PubChem CID 63584460) has the molecular formula C14H28N4O and a molecular weight of 268.40 g/mol. Its IUPAC name is 4-(3-piperidin-1-ylpyrrolidin-1-yl)pentanehydrazide.

Molecular Properties

Compound Name4-(3-piperidin-1-ylpyrrolidin-1-yl)pentanehydrazide
PubChem CID63584460
Molecular FormulaC14H28N4O
Molecular Weight268.40 g/mol
Exact Mass268.23
IUPAC Name4-(3-piperidin-1-ylpyrrolidin-1-yl)pentanehydrazide
SMILESCC(CCC(=O)NN)N1CCC(N2CCCCC2)C1
InChIInChI=1S/C14H28N4O/c1-12(5-6-14(19)16-15)18-10-7-13(11-18)17-8-3-2-4-9-17/h12-13H,2-11,15H2,1H3,(H,16,19)
InChIKeyVWEDPUUGALEOJZ-UHFFFAOYSA-N
XLogP0.71
TPSA61.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 50.71
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-(3-piperidin-1-ylpyrrolidin-1-yl)pentanehydrazide 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-piperidin-1-ylpyrrolidin-1-yl)pentanehydrazide?
The IUPAC name of 4-(3-piperidin-1-ylpyrrolidin-1-yl)pentanehydrazide (CID 63584460) is 4-(3-piperidin-1-ylpyrrolidin-1-yl)pentanehydrazide.
What is the SMILES notation for 4-(3-piperidin-1-ylpyrrolidin-1-yl)pentanehydrazide?
The canonical SMILES for 4-(3-piperidin-1-ylpyrrolidin-1-yl)pentanehydrazide is CC(CCC(=O)NN)N1CCC(N2CCCCC2)C1.
What is the InChIKey of 4-(3-piperidin-1-ylpyrrolidin-1-yl)pentanehydrazide?
The InChIKey is VWEDPUUGALEOJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N4O/c1-12(5-6-14(19)16-15)18-10-7-13(11-18)17-8-3-2-4-9-17/h12-13H,2-11,15H2,1H3,(H,16,19).
What are the key properties of 4-(3-piperidin-1-ylpyrrolidin-1-yl)pentanehydrazide?
4-(3-piperidin-1-ylpyrrolidin-1-yl)pentanehydrazide has a molecular weight of 268.40 g/mol, XLogP of 0.71, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-piperidin-1-ylpyrrolidin-1-yl)pentanehydrazide is sourced from PubChem (CID 63584460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).