Basic information
- Standard SMILES
CCN1C(=O)C2CC(c3ccc(N)cc3)(C2)C1=O- InChIKey
RCAAOUHFDKDMPQ-UHFFFAOYSA-N- Molecular formula
- C14H16N2O2
- Average molar mass
- 244.29 g/mol
Names & identifiers
- Preferred name
- 1-(4-Aminophenyl)-3-ethyl-3-azabicyclo[3.1.1]heptane-2,4-dione
- IUPAC
- 1-(4-aminophenyl)-3-ethyl-3-azabicyclo[3.1.1]heptane-2,4-dione
Names & synonyms
SCHEMBL10349995RCAAOUHFDKDMPQ-UHFFFAOYSA-N1-(4-aminophenyl)-3-ethyl-3-azabicyclo[3.1.1]heptane-2,4-dione
Database identifiers
- PubChem CID
- 20027809
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 63.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 379
Related reactions
4 records
Compound notes
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