4-(pyridin-4-yldiazenyl)-1H-pyrazole-3,5-diamine

C8H9N7 — CID 135744101

IUPAC4-(pyridin-4-yldiazenyl)-1H-pyrazole-3,5-diamine
SMILESNc1n[nH]c(N)c1/N=N/c1ccncc1
InChIInChI=1S/C8H9N7/c9-7-6(8(10)15-14-7)13-12-5-1-3-11-4-2-5/h1-4H,(H5,9,10,14,15)/b13-12+
InChIKeyRZLCSJZALMLKCU-OUKQBFOZSA-N
MW203.21 g/mol
LogP1.38
Rot. Bonds2

About 4-(pyridin-4-yldiazenyl)-1H-pyrazole-3,5-diamine

4-(pyridin-4-yldiazenyl)-1H-pyrazole-3,5-diamine (PubChem CID 135744101) has the molecular formula C8H9N7 and a molecular weight of 203.21 g/mol. Its IUPAC name is 4-(pyridin-4-yldiazenyl)-1H-pyrazole-3,5-diamine.

Molecular Properties

Compound Name4-(pyridin-4-yldiazenyl)-1H-pyrazole-3,5-diamine
PubChem CID135744101
Molecular FormulaC8H9N7
Molecular Weight203.21 g/mol
Exact Mass203.09
IUPAC Name4-(pyridin-4-yldiazenyl)-1H-pyrazole-3,5-diamine
SMILESNc1n[nH]c(N)c1/N=N/c1ccncc1
InChIInChI=1S/C8H9N7/c9-7-6(8(10)15-14-7)13-12-5-1-3-11-4-2-5/h1-4H,(H5,9,10,14,15)/b13-12+
InChIKeyRZLCSJZALMLKCU-OUKQBFOZSA-N
XLogP1.38
TPSA118.33 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.21
LogP ≤ 51.38
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze 4-(pyridin-4-yldiazenyl)-1H-pyrazole-3,5-diamine 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-(pyridin-4-yldiazenyl)-1H-pyrazole-3,5-diamine?
The IUPAC name of 4-(pyridin-4-yldiazenyl)-1H-pyrazole-3,5-diamine (CID 135744101) is 4-(pyridin-4-yldiazenyl)-1H-pyrazole-3,5-diamine.
What is the SMILES notation for 4-(pyridin-4-yldiazenyl)-1H-pyrazole-3,5-diamine?
The canonical SMILES for 4-(pyridin-4-yldiazenyl)-1H-pyrazole-3,5-diamine is Nc1n[nH]c(N)c1/N=N/c1ccncc1.
What is the InChIKey of 4-(pyridin-4-yldiazenyl)-1H-pyrazole-3,5-diamine?
The InChIKey is RZLCSJZALMLKCU-OUKQBFOZSA-N. The full InChI is InChI=1S/C8H9N7/c9-7-6(8(10)15-14-7)13-12-5-1-3-11-4-2-5/h1-4H,(H5,9,10,14,15)/b13-12+.
What are the key properties of 4-(pyridin-4-yldiazenyl)-1H-pyrazole-3,5-diamine?
4-(pyridin-4-yldiazenyl)-1H-pyrazole-3,5-diamine has a molecular weight of 203.21 g/mol, XLogP of 1.38, 2 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(pyridin-4-yldiazenyl)-1H-pyrazole-3,5-diamine is sourced from PubChem (CID 135744101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).