Basic information
- CAS
1199-72-0- Standard SMILES
NCCN1CC2CCC(CC2)C1- InChIKey
CMDZCNVXUJPTRB-UHFFFAOYSA-N- Molecular formula
- C10H20N2
- Average molar mass
- 168.28 g/mol
- Monoisotopic mass
- 168.16264865
Names & identifiers
- Preferred name
- 3-Azabicyclo[3.2.2]nonane-3-ethanamine
- IUPAC
- 2-(3-azabicyclo[3.2.2]nonan-3-yl)ethanamine
Names & synonyms
NSC6592623-Azabicyclo[3.2.2]nonane-3-ethanamine1199-72-02-(3-azabicyclo[3.2.2]nonan-3-yl)ethanamineCHEMBL2008370SCHEMBL11864873DTXSID001282354NCI60_0209232-(3-Azabicyclo[3.2.2]nonan-3-yl)ethan-1-amine2-(3-Azabicyclo[3.2.2]non-3-yl)ethanamine acetate
Database identifiers
- CAS
1199-72-0- PubChem CID
- 377682
- DTXSID
DTXSID001282354- ChEMBL
CHEMBL2008370
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 29.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 125
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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