6-azabicyclo[3.2.2]nonane-4,8-diamine

C8H17N3 — CID 22316154

IUPAC6-azabicyclo[3.2.2]nonane-4,8-diamine
SMILESNC1CC2NCC1CCC2N
InChIInChI=1S/C8H17N3/c9-6-2-1-5-4-11-8(6)3-7(5)10/h5-8,11H,1-4,9-10H2
InChIKeyGKILRXCKCZWNEI-UHFFFAOYSA-N
MW155.24 g/mol
LogP-0.59
Rot. Bonds

About 6-azabicyclo[3.2.2]nonane-4,8-diamine

6-azabicyclo[3.2.2]nonane-4,8-diamine (PubChem CID 22316154) has the molecular formula C8H17N3 and a molecular weight of 155.24 g/mol. Its IUPAC name is 6-azabicyclo[3.2.2]nonane-4,8-diamine.

Molecular Properties

Compound Name6-azabicyclo[3.2.2]nonane-4,8-diamine
PubChem CID22316154
Molecular FormulaC8H17N3
Molecular Weight155.24 g/mol
Exact Mass155.14
IUPAC Name6-azabicyclo[3.2.2]nonane-4,8-diamine
SMILESNC1CC2NCC1CCC2N
InChIInChI=1S/C8H17N3/c9-6-2-1-5-4-11-8(6)3-7(5)10/h5-8,11H,1-4,9-10H2
InChIKeyGKILRXCKCZWNEI-UHFFFAOYSA-N
XLogP-0.59
TPSA64.07 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 5-0.59
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 6-azabicyclo[3.2.2]nonane-4,8-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-azabicyclo[3.2.2]nonane-4,8-diamine?
The IUPAC name of 6-azabicyclo[3.2.2]nonane-4,8-diamine (CID 22316154) is 6-azabicyclo[3.2.2]nonane-4,8-diamine.
What is the SMILES notation for 6-azabicyclo[3.2.2]nonane-4,8-diamine?
The canonical SMILES for 6-azabicyclo[3.2.2]nonane-4,8-diamine is NC1CC2NCC1CCC2N.
What is the InChIKey of 6-azabicyclo[3.2.2]nonane-4,8-diamine?
The InChIKey is GKILRXCKCZWNEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N3/c9-6-2-1-5-4-11-8(6)3-7(5)10/h5-8,11H,1-4,9-10H2.
What are the key properties of 6-azabicyclo[3.2.2]nonane-4,8-diamine?
6-azabicyclo[3.2.2]nonane-4,8-diamine has a molecular weight of 155.24 g/mol, XLogP of -0.59, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-azabicyclo[3.2.2]nonane-4,8-diamine is sourced from PubChem (CID 22316154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).