(3-diazenyl-1H-pyrrol-2-yl)hydrazine

C4H7N5 — CID 155819213

IUPAC(3-diazenyl-1H-pyrrol-2-yl)hydrazine
SMILES[H]/N=N/c1cc[nH]c1NN
InChIInChI=1S/C4H7N5/c5-8-3-1-2-7-4(3)9-6/h1-2,5,7,9H,6H2/b8-5+
InChIKeyFQDIOQTXHQKVHW-VMPITWQZSA-N
MW125.13 g/mol
LogP0.96
Rot. Bonds2

About (3-diazenyl-1H-pyrrol-2-yl)hydrazine

(3-diazenyl-1H-pyrrol-2-yl)hydrazine (PubChem CID 155819213) has the molecular formula C4H7N5 and a molecular weight of 125.13 g/mol. Its IUPAC name is (3-diazenyl-1H-pyrrol-2-yl)hydrazine.

Molecular Properties

Compound Name(3-diazenyl-1H-pyrrol-2-yl)hydrazine
PubChem CID155819213
Molecular FormulaC4H7N5
Molecular Weight125.13 g/mol
Exact Mass125.07
IUPAC Name(3-diazenyl-1H-pyrrol-2-yl)hydrazine
SMILES[H]/N=N/c1cc[nH]c1NN
InChIInChI=1S/C4H7N5/c5-8-3-1-2-7-4(3)9-6/h1-2,5,7,9H,6H2/b8-5+
InChIKeyFQDIOQTXHQKVHW-VMPITWQZSA-N
XLogP0.96
TPSA90.05 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.13
LogP ≤ 50.96
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2,4-Diaminopyrrole
CID 19935251
Diaminoazole
CID 20540606
Azolylhydrazine
CID 67965327
Triaminoazole
CID 129813375
1-fluoro-2-(1H-pyrrol-3-yl)hydrazine
CID 141144948
3-(4-fluoropyrazol-1-yl)-1H-pyrrol-2-amine
CID 164898715
Azolylthiosemicarbazide
CID 129698267
1-Azolylaminopyridine
CID 129787879
Triazeno-pyrrole
CID 136656474
N-pyrrolylcarbohydrazide
CID 162640047
1-(1H-Pyrrol-2-yl)-1H-pyrazole-4,5-diamine
CID 22062260
1-(1H-Pyrrol-3-yl)-1H-pyrazole-4,5-diamine
CID 22062293

Frequently Asked Questions

What is the IUPAC name of (3-diazenyl-1H-pyrrol-2-yl)hydrazine?
The IUPAC name of (3-diazenyl-1H-pyrrol-2-yl)hydrazine (CID 155819213) is (3-diazenyl-1H-pyrrol-2-yl)hydrazine.
What is the SMILES notation for (3-diazenyl-1H-pyrrol-2-yl)hydrazine?
The canonical SMILES for (3-diazenyl-1H-pyrrol-2-yl)hydrazine is [H]/N=N/c1cc[nH]c1NN.
What is the InChIKey of (3-diazenyl-1H-pyrrol-2-yl)hydrazine?
The InChIKey is FQDIOQTXHQKVHW-VMPITWQZSA-N. The full InChI is InChI=1S/C4H7N5/c5-8-3-1-2-7-4(3)9-6/h1-2,5,7,9H,6H2/b8-5+.
What are the key properties of (3-diazenyl-1H-pyrrol-2-yl)hydrazine?
(3-diazenyl-1H-pyrrol-2-yl)hydrazine has a molecular weight of 125.13 g/mol, XLogP of 0.96, 2 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-diazenyl-1H-pyrrol-2-yl)hydrazine is sourced from PubChem (CID 155819213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).