Basic information
- Standard SMILES
CC(C)(C)OC(=O)N1CC2CC(CC(C(=O)c3ccco3)C2)C1- InChIKey
PQLVDURARHSBJP-UHFFFAOYSA-N- Molecular formula
- C18H25NO4
- Average molar mass
- 319.4 g/mol
Names & identifiers
- Preferred name
- 2-Furanyl(3-(tert-butoxycarbonyl)-3-azabicyclo[3.3.1]non-7-yl)methanone
- IUPAC
- tert-butyl 7-(furan-2-carbonyl)-3-azabicyclo[3.3.1]nonane-3-carboxylate
Names & synonyms
SCHEMBL2994262PQLVDURARHSBJP-UHFFFAOYSA-N2-furanyl(3-(tert-butoxycarbonyl)-3-azabicyclo[3.3.1]non-7-yl)methanone
Database identifiers
- PubChem CID
- 68469839
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 59.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 456
Related reactions
1 records
Compound notes
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