diazenyl(pyrrolidin-1-yl)azanide

C4H9N4- — CID 20637239

IUPACdiazenyl(pyrrolidin-1-yl)azanide
SMILES[H]/N=N/[N-]N1CCCC1
InChIInChI=1S/C4H9N4/c5-6-7-8-3-1-2-4-8/h1-4H2,(H-,5,7)/q-1
InChIKeyCLMHVHQEZJUYCY-UHFFFAOYSA-N
MW113.14 g/mol
LogP1.32
Rot. Bonds2

About diazenyl(pyrrolidin-1-yl)azanide

diazenyl(pyrrolidin-1-yl)azanide (PubChem CID 20637239) has the molecular formula C4H9N4- and a molecular weight of 113.14 g/mol. Its IUPAC name is diazenyl(pyrrolidin-1-yl)azanide.

Molecular Properties

Compound Namediazenyl(pyrrolidin-1-yl)azanide
PubChem CID20637239
Molecular FormulaC4H9N4-
Molecular Weight113.14 g/mol
Exact Mass113.08
IUPAC Namediazenyl(pyrrolidin-1-yl)azanide
SMILES[H]/N=N/[N-]N1CCCC1
InChIInChI=1S/C4H9N4/c5-6-7-8-3-1-2-4-8/h1-4H2,(H-,5,7)/q-1
InChIKeyCLMHVHQEZJUYCY-UHFFFAOYSA-N
XLogP1.32
TPSA53.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.14
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze diazenyl(pyrrolidin-1-yl)azanide 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 diazenyl(pyrrolidin-1-yl)azanide?
The IUPAC name of diazenyl(pyrrolidin-1-yl)azanide (CID 20637239) is diazenyl(pyrrolidin-1-yl)azanide.
What is the SMILES notation for diazenyl(pyrrolidin-1-yl)azanide?
The canonical SMILES for diazenyl(pyrrolidin-1-yl)azanide is [H]/N=N/[N-]N1CCCC1.
What is the InChIKey of diazenyl(pyrrolidin-1-yl)azanide?
The InChIKey is CLMHVHQEZJUYCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9N4/c5-6-7-8-3-1-2-4-8/h1-4H2,(H-,5,7)/q-1.
What are the key properties of diazenyl(pyrrolidin-1-yl)azanide?
diazenyl(pyrrolidin-1-yl)azanide has a molecular weight of 113.14 g/mol, XLogP of 1.32, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for diazenyl(pyrrolidin-1-yl)azanide is sourced from PubChem (CID 20637239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).