pentazadiene

H3N5 — CID 23436648

IUPAC—
SMILES[H]/N=N/N=N/N
InChIInChI=1S/H3N5/c1-3-5-4-2/h(H3,1,2,5)
InChIKeyNYESEEYVQKFGTJ-UHFFFAOYSA-N
MW73.06 g/mol
LogP0.26
Rot. Bonds1

About pentazadiene

pentazadiene (PubChem CID 23436648) has the molecular formula H3N5 and a molecular weight of 73.06 g/mol.

Molecular Properties

Compound Namepentazadiene
PubChem CID23436648
Molecular FormulaH3N5
Molecular Weight73.06 g/mol
Exact Mass73.04
IUPAC Name—
SMILES[H]/N=N/N=N/N
InChIInChI=1S/H3N5/c1-3-5-4-2/h(H3,1,2,5)
InChIKeyNYESEEYVQKFGTJ-UHFFFAOYSA-N
XLogP0.26
TPSA86.95 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50073.06
LogP ≤ 50.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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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Frequently Asked Questions

What is the IUPAC name of pentazadiene?
The IUPAC name of pentazadiene (CID 23436648) is not available.
What is the SMILES notation for pentazadiene?
The canonical SMILES for pentazadiene is [H]/N=N/N=N/N.
What is the InChIKey of pentazadiene?
The InChIKey is NYESEEYVQKFGTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/H3N5/c1-3-5-4-2/h(H3,1,2,5).
What are the key properties of pentazadiene?
pentazadiene has a molecular weight of 73.06 g/mol, XLogP of 0.26, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for pentazadiene is sourced from PubChem (CID 23436648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).