3,7-Diallyl-3,7-diazabicyclo[3.3.1]nonan-9-one
Basic information
- CAS
927801-00-1- Standard SMILES
C=CCN1CC2CN(CC=C)CC(C1)C2=O- InChIKey
LIZPETKCJUBIKY-UHFFFAOYSA-N- Molecular formula
- C13H20N2O
- Average molar mass
- 220.31 g/mol
- Monoisotopic mass
- 220.15756327
Names & identifiers
- Preferred name
- 3,7-Diallyl-3,7-diazabicyclo[3.3.1]nonan-9-one
- IUPAC
- 3,7-bis(prop-2-enyl)-3,7-diazabicyclo[3.3.1]nonan-9-one
Names & synonyms
3,7-Diallyl-3,7-diazabicyclo[3.3.1]nonan-9-one927801-00-13,7-Bis(prop-2-enyl)-3,7-diazabicyclo[3.3.1]nonan-9-oneDTXSID8012039343,7-Di-2-propen-1-yl-3,7-diazabicyclo[3.3.1]nonan-9-one3,7-bis(prop-2-en-1-yl)-3,7-diazabicyclo[3.3.1]nonan-9-one3,7-Di(prop-2-en-1-yl)-3,7-diazabicyclo[3.3.1]nonan-9-one
Database identifiers
- CAS
927801-00-1- PubChem CID
- 15906293
- DTXSID
DTXSID801203934
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 23.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 260
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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