nonan-5-yldiazene

C9H20N2 — CID 123930065

IUPACnonan-5-yldiazene
SMILES[H]/N=N/C(CCCC)CCCC
InChIInChI=1S/C9H20N2/c1-3-5-7-9(11-10)8-6-4-2/h9-10H,3-8H2,1-2H3/b11-10+
InChIKeyUDLWIRBSWBWQBZ-ZHACJKMWSA-N
MW156.27 g/mol
LogP3.77
Rot. Bonds7

About nonan-5-yldiazene

nonan-5-yldiazene (PubChem CID 123930065) has the molecular formula C9H20N2 and a molecular weight of 156.27 g/mol. Its IUPAC name is nonan-5-yldiazene.

Molecular Properties

Compound Namenonan-5-yldiazene
PubChem CID123930065
Molecular FormulaC9H20N2
Molecular Weight156.27 g/mol
Exact Mass156.16
IUPAC Namenonan-5-yldiazene
SMILES[H]/N=N/C(CCCC)CCCC
InChIInChI=1S/C9H20N2/c1-3-5-7-9(11-10)8-6-4-2/h9-10H,3-8H2,1-2H3/b11-10+
InChIKeyUDLWIRBSWBWQBZ-ZHACJKMWSA-N
XLogP3.77
TPSA36.21 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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 nonan-5-yldiazene?
The IUPAC name of nonan-5-yldiazene (CID 123930065) is nonan-5-yldiazene.
What is the SMILES notation for nonan-5-yldiazene?
The canonical SMILES for nonan-5-yldiazene is [H]/N=N/C(CCCC)CCCC.
What is the InChIKey of nonan-5-yldiazene?
The InChIKey is UDLWIRBSWBWQBZ-ZHACJKMWSA-N. The full InChI is InChI=1S/C9H20N2/c1-3-5-7-9(11-10)8-6-4-2/h9-10H,3-8H2,1-2H3/b11-10+.
What are the key properties of nonan-5-yldiazene?
nonan-5-yldiazene has a molecular weight of 156.27 g/mol, XLogP of 3.77, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for nonan-5-yldiazene is sourced from PubChem (CID 123930065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).