1-adamantyldiazene

C10H16N2 — CID 90243235

IUPAC1-adamantyldiazene
SMILES[H]/N=N/C12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C10H16N2/c11-12-10-4-7-1-8(5-10)3-9(2-7)6-10/h7-9,11H,1-6H2/b12-11+
InChIKeyFNOKUHVDXPAWNL-VAWYXSNFSA-N
MW164.25 g/mol
LogP2.99
Rot. Bonds1

About 1-adamantyldiazene

1-adamantyldiazene (PubChem CID 90243235) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is 1-adamantyldiazene.

Molecular Properties

Compound Name1-adamantyldiazene
PubChem CID90243235
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC Name1-adamantyldiazene
SMILES[H]/N=N/C12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C10H16N2/c11-12-10-4-7-1-8(5-10)3-9(2-7)6-10/h7-9,11H,1-6H2/b12-11+
InChIKeyFNOKUHVDXPAWNL-VAWYXSNFSA-N
XLogP2.99
TPSA36.21 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 52.99
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 1-adamantyldiazene?
The IUPAC name of 1-adamantyldiazene (CID 90243235) is 1-adamantyldiazene.
What is the SMILES notation for 1-adamantyldiazene?
The canonical SMILES for 1-adamantyldiazene is [H]/N=N/C12CC3CC(CC(C3)C1)C2.
What is the InChIKey of 1-adamantyldiazene?
The InChIKey is FNOKUHVDXPAWNL-VAWYXSNFSA-N. The full InChI is InChI=1S/C10H16N2/c11-12-10-4-7-1-8(5-10)3-9(2-7)6-10/h7-9,11H,1-6H2/b12-11+.
What are the key properties of 1-adamantyldiazene?
1-adamantyldiazene has a molecular weight of 164.25 g/mol, XLogP of 2.99, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-adamantyldiazene is sourced from PubChem (CID 90243235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).