Structure Info
- Chemspace ID
- CSMB02125677551 (Enamine MADE)
- IUPAC Name
- rac-tert-butyl (1R,4R)-5-(cyanomethyl)-2,5-diazabicyclo[2.2.1]heptane-2-carboxylate
- Mol formula
- C12H19N3O2
- Mol weight
- 237 Da
- Catalog Number(s)
- BBV-183378131
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 0.48
- Heavy atoms count
- 17
- Rotatable bond count
- 3
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.833
- Polar surface area (Å)
- 57
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB02125677551
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