Basic information
- Standard SMILES
C=CCO[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NCc1ccccc1- InChIKey
RDTSIRFFUADXCU-ZWKOTPCHSA-N- Molecular formula
- C20H30N2O3
- Average molar mass
- 346.5 g/mol
- Monoisotopic mass
- 346.22564282
Names & identifiers
- Preferred name
- tert-Butyl cis(+/-)-4-(benzylamino)-3-allyloxypiperidine-1-carboxylate
- IUPAC
- tert-butyl (3R,4S)-4-(benzylamino)-3-prop-2-enoxypiperidine-1-carboxylate
Names & synonyms
RDTSIRFFUADXCU-ZWKOTPCHSA-Ntert-Butyl cis(+/-)-4-(benzylamino)-3-allyloxypiperidine-1-carboxylate
Database identifiers
- PubChem CID
- 86648602
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 50.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 427
Related reactions
3 records
Compound notes
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