CID 139116477

H4N12 — CID 139116477

IUPAC—
SMILES[N-]=[N+]=N.[N-]=[N+]=N.[N-]=[N+]=N.[N-]=[N+]=N
InChIInChI=1S/4HN3/c4*1-3-2/h4*1H
InChIKeyMDSHFFGJMSELIC-UHFFFAOYSA-N
MW172.12 g/mol
LogP3.50
Rot. Bonds

About CID 139116477

CID 139116477 (PubChem CID 139116477) has the molecular formula H4N12 and a molecular weight of 172.12 g/mol.

Molecular Properties

Compound NameCID 139116477
PubChem CID139116477
Molecular FormulaH4N12
Molecular Weight172.12 g/mol
Exact Mass172.07
IUPAC Name—
SMILES[N-]=[N+]=N.[N-]=[N+]=N.[N-]=[N+]=N.[N-]=[N+]=N
InChIInChI=1S/4HN3/c4*1-3-2/h4*1H
InChIKeyMDSHFFGJMSELIC-UHFFFAOYSA-N
XLogP3.50
TPSA241.00 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.12
LogP ≤ 53.50
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

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Related Compounds

Tetraaz-1-ene
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Hexaaza-1,5-diene
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Diazokomponente Diamine
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CID 139212583
Ammonium azide [Forbidden]
CID 61555
CID 143165
CID 143165
Iminoazanide;technetium(7+)
CID 18672976
CID 19078066
CID 19078066
(E)-bis[(E)-[(E)-[(E)-[(E)-diazenyldiazenyl]diazenyl]diazenyl]diazenyl]diazene
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(E)-bis[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-diazenyldiazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazene
CID 20769868
(E)-bis[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-diazenyldiazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazene
CID 20769869
(E)-bis[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-[(E)-diazenyldiazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazenyl]diazene
CID 20769870

Frequently Asked Questions

What is the IUPAC name of CID 139116477?
The IUPAC name of CID 139116477 (CID 139116477) is not available.
What is the SMILES notation for CID 139116477?
The canonical SMILES for CID 139116477 is [N-]=[N+]=N.[N-]=[N+]=N.[N-]=[N+]=N.[N-]=[N+]=N.
What is the InChIKey of CID 139116477?
The InChIKey is MDSHFFGJMSELIC-UHFFFAOYSA-N. The full InChI is InChI=1S/4HN3/c4*1-3-2/h4*1H.
What are the key properties of CID 139116477?
CID 139116477 has a molecular weight of 172.12 g/mol, XLogP of 3.50, 0 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 139116477 is sourced from PubChem (CID 139116477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).