N'-hydroxy-4-piperidin-1-ylbutanimidamide

C9H19N3O — CID 7358501

IUPACN'-hydroxy-4-piperidin-1-ylbutanimidamide
SMILESN/C(CCCN1CCCCC1)=N\O
InChIInChI=1S/C9H19N3O/c10-9(11-13)5-4-8-12-6-2-1-3-7-12/h13H,1-8H2,(H2,10,11)
InChIKeyUUIRQFMZIGGUJL-UHFFFAOYSA-N
MW185.27 g/mol
LogP1.00
Rot. Bonds4

About N'-hydroxy-4-piperidin-1-ylbutanimidamide

N'-hydroxy-4-piperidin-1-ylbutanimidamide (PubChem CID 7358501) has the molecular formula C9H19N3O and a molecular weight of 185.27 g/mol. Its IUPAC name is N'-hydroxy-4-piperidin-1-ylbutanimidamide.

Molecular Properties

Compound NameN'-hydroxy-4-piperidin-1-ylbutanimidamide
PubChem CID7358501
Molecular FormulaC9H19N3O
Molecular Weight185.27 g/mol
Exact Mass185.15
IUPAC NameN'-hydroxy-4-piperidin-1-ylbutanimidamide
SMILESN/C(CCCN1CCCCC1)=N\O
InChIInChI=1S/C9H19N3O/c10-9(11-13)5-4-8-12-6-2-1-3-7-12/h13H,1-8H2,(H2,10,11)
InChIKeyUUIRQFMZIGGUJL-UHFFFAOYSA-N
XLogP1.00
TPSA61.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N'-hydroxy-4-piperidin-1-ylbutanimidamide 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 N'-hydroxy-4-piperidin-1-ylbutanimidamide?
The IUPAC name of N'-hydroxy-4-piperidin-1-ylbutanimidamide (CID 7358501) is N'-hydroxy-4-piperidin-1-ylbutanimidamide.
What is the SMILES notation for N'-hydroxy-4-piperidin-1-ylbutanimidamide?
The canonical SMILES for N'-hydroxy-4-piperidin-1-ylbutanimidamide is N/C(CCCN1CCCCC1)=N\O.
What is the InChIKey of N'-hydroxy-4-piperidin-1-ylbutanimidamide?
The InChIKey is UUIRQFMZIGGUJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3O/c10-9(11-13)5-4-8-12-6-2-1-3-7-12/h13H,1-8H2,(H2,10,11).
What are the key properties of N'-hydroxy-4-piperidin-1-ylbutanimidamide?
N'-hydroxy-4-piperidin-1-ylbutanimidamide has a molecular weight of 185.27 g/mol, XLogP of 1.00, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-hydroxy-4-piperidin-1-ylbutanimidamide is sourced from PubChem (CID 7358501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).