Basic information
- Standard SMILES
CC(C)(C)OC(=O)NC1CCN(C(=O)OC2C3CC4CC2CC(C(N)=O)(C4)C3)C1- InChIKey
VHQZXUBTPDOCIZ-UHFFFAOYSA-N- Molecular formula
- C21H33N3O5
- Average molar mass
- 407.5 g/mol
Names & identifiers
- Preferred name
- (1-Carbamoyl-4-adamantyl) 3-(tert-butoxycarbonylamino)pyrrolidine-1-carboxylate
- IUPAC
- (5-carbamoyl-2-adamantyl) 3-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrolidine-1-carboxylate
Names & synonyms
VHQZXUBTPDOCIZ-UHFFFAOYSA-N(1-carbamoyl-4-adamantyl) 3-(tert-butoxycarbonylamino)pyrrolidine-1-carboxylate
Database identifiers
- PubChem CID
- 75968129
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 111 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 687
Related reactions
4 records
Compound notes
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