Basic information
- Standard SMILES
CC(C)(C)OC(=O)N1CC2C=C(C(=O)c3ccco3)CC2C1- InChIKey
GAWPRCSDDXYNDS-UHFFFAOYSA-N- Molecular formula
- C17H21NO4
- Average molar mass
- 303.35 g/mol
- Monoisotopic mass
- 303.14705815
Names & identifiers
- Preferred name
- 2-Furanyl(3-(tert-butoxycarbonyl)-3-azabicyclo[3.3.0]oct-6-en-7-yl)methanone
- IUPAC
- tert-butyl 5-(furan-2-carbonyl)-3,3a,6,6a-tetrahydro-1H-cyclopenta[c]pyrrole-2-carboxylate
Names & synonyms
SCHEMBL2993400GAWPRCSDDXYNDS-UHFFFAOYSA-N2-furanyl(3-(tert-butoxycarbonyl)-3-azabicyclo[3.3.0]oct-6-en-7-yl)methanone
Database identifiers
- PubChem CID
- 68469512
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 59.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 505
Related reactions
4 records
Compound notes
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