4-diazenyl-1H-pyrazol-5-amine

C3H5N5 — CID 135753366

IUPAC4-diazenyl-1H-pyrazol-5-amine
SMILES[H]/N=N/c1cn[nH]c1N
InChIInChI=1S/C3H5N5/c4-3-2(7-5)1-6-8-3/h1,5H,(H3,4,6,8)/b7-5+
InChIKeyIZOXSKVTVWATGB-FNORWQNLSA-N
MW111.11 g/mol
LogP0.65
Rot. Bonds1

About 4-diazenyl-1H-pyrazol-5-amine

4-diazenyl-1H-pyrazol-5-amine (PubChem CID 135753366) has the molecular formula C3H5N5 and a molecular weight of 111.11 g/mol. Its IUPAC name is 4-diazenyl-1H-pyrazol-5-amine.

Molecular Properties

Compound Name4-diazenyl-1H-pyrazol-5-amine
PubChem CID135753366
Molecular FormulaC3H5N5
Molecular Weight111.11 g/mol
Exact Mass111.05
IUPAC Name4-diazenyl-1H-pyrazol-5-amine
SMILES[H]/N=N/c1cn[nH]c1N
InChIInChI=1S/C3H5N5/c4-3-2(7-5)1-6-8-3/h1,5H,(H3,4,6,8)/b7-5+
InChIKeyIZOXSKVTVWATGB-FNORWQNLSA-N
XLogP0.65
TPSA90.91 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500111.11
LogP ≤ 50.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-diazenyl-1H-pyrazol-5-amine?
The IUPAC name of 4-diazenyl-1H-pyrazol-5-amine (CID 135753366) is 4-diazenyl-1H-pyrazol-5-amine.
What is the SMILES notation for 4-diazenyl-1H-pyrazol-5-amine?
The canonical SMILES for 4-diazenyl-1H-pyrazol-5-amine is [H]/N=N/c1cn[nH]c1N.
What is the InChIKey of 4-diazenyl-1H-pyrazol-5-amine?
The InChIKey is IZOXSKVTVWATGB-FNORWQNLSA-N. The full InChI is InChI=1S/C3H5N5/c4-3-2(7-5)1-6-8-3/h1,5H,(H3,4,6,8)/b7-5+.
What are the key properties of 4-diazenyl-1H-pyrazol-5-amine?
4-diazenyl-1H-pyrazol-5-amine has a molecular weight of 111.11 g/mol, XLogP of 0.65, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-diazenyl-1H-pyrazol-5-amine is sourced from PubChem (CID 135753366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).