Basic information
- Standard SMILES
CC(C)(C)OC(=O)C1CC2(CN)CCC1(CN)CC2- InChIKey
MLMLFNQYBDUTMB-UHFFFAOYSA-N- Molecular formula
- C15H28N2O2
- Average molar mass
- 268.39 g/mol
Names & identifiers
- Preferred name
- Boc-4-aminomethylbicyclo-[2.2.2]octane methylamine
- IUPAC
- tert-butyl 1,4-bis(aminomethyl)bicyclo[2.2.2]octane-2-carboxylate
Names & synonyms
MLMLFNQYBDUTMB-UHFFFAOYSA-NBoc-4-aminomethylbicyclo-[2.2.2]octane methylamine
Database identifiers
- PubChem CID
- 131722017
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 78.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 352
Related reactions
1 records
Compound notes
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