Basic information
- Standard SMILES
CC(C)(C)OC(=O)N1CCNCC1C(O)C(N)Cc1ccccc1- InChIKey
JUEPZLNGVDMRMY-UHFFFAOYSA-N- Molecular formula
- C18H29N3O3
- Average molar mass
- 335.4 g/mol
- Monoisotopic mass
- 335.2208918
Names & identifiers
- Preferred name
- Tert-butyl 2-(2-amino-1-hydroxy-3-phenylpropyl)piperazine-1-carboxylate
- IUPAC
- tert-butyl 2-(2-amino-1-hydroxy-3-phenylpropyl)piperazine-1-carboxylate
Names & synonyms
SCHEMBL4361447
Database identifiers
- PubChem CID
- 69016338
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 87.8 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 405
Related reactions
2 records
Compound notes
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