Basic information
- Standard SMILES
CCOC(=O)C(=O)N(CC(C)C)[C@H]1C[C@@H](C(=O)N2CCOCC2)CN(C(=O)OC(C)(C)C)C1- InChIKey
IYYBKXGGYIQXMC-MSOLQXFVSA-N- Molecular formula
- C23H39N3O7
- Average molar mass
- 469.6 g/mol
- Monoisotopic mass
- 469.27880059
Names & identifiers
- Preferred name
- tert-butyl (3S,5R)-3-{[ethoxy(oxo)acetyl](2-methylpropyl)amino}-5-(morpholin-4-ylcarbonyl)piperidine-1-carboxylate
- IUPAC
- tert-butyl (3S,5R)-3-[(2-ethoxy-2-oxoacetyl)-(2-methylpropyl)amino]-5-(morpholine-4-carbonyl)piperidine-1-carboxylate
Names & synonyms
SCHEMBL1421226IYYBKXGGYIQXMC-MSOLQXFVSA-Ntert-butyl (3S,5R)-3-{[ethoxy(oxo)acetyl](2-methylpropyl)amino}-5-(morpholin-4-ylcarbonyl)piperidine-1-carboxylate
Database identifiers
- PubChem CID
- 58355657
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 106 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 9
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 713
Related reactions
8 records
Compound notes
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