Basic information
- Standard SMILES
CNCC(CC12CCC(CC1)CC2)NC(=O)OCc1ccccc1- InChIKey
PHAOHVSTMNKBKK-UHFFFAOYSA-N- Molecular formula
- C20H30N2O2
- Average molar mass
- 330.5 g/mol
Names & identifiers
- Preferred name
- Benzyl 1-(bicyclo[2.2.2]octan-1-yl)-3-(methylamino)propan-2-ylcarbamate
- IUPAC
- benzyl N-[1-(1-bicyclo[2.2.2]octanyl)-3-(methylamino)propan-2-yl]carbamate
Names & synonyms
SCHEMBL3607283PHAOHVSTMNKBKK-UHFFFAOYSA-Nbenzyl 1-(bicyclo[2.2.2]octan-1-yl)-3-(methylamino)propan-2-ylcarbamate
Database identifiers
- PubChem CID
- 59201448
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 50.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 8
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 385
Related reactions
1 records
Compound notes
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