Basic information
- Standard SMILES
O=C1CC2(CCCC2)CC(=O)N1CCN1CCN(c2ccc(F)c(F)c2)CC1- InChIKey
RZWIBVNDYKVOQZ-UHFFFAOYSA-N- Molecular formula
- C21H27F2N3O2
- Average molar mass
- 391.5 g/mol
Names & identifiers
- Preferred name
- 8-{2-[4-(3,4-Difluorophenyl)piperazin-1-yl]ethyl}-8-azaspiro[4.5]decane-7,9-dione
- IUPAC
- 8-[2-[4-(3,4-difluorophenyl)piperazin-1-yl]ethyl]-8-azaspiro[4.5]decane-7,9-dione
Names & synonyms
CHEMBL192099SCHEMBL6754644RZWIBVNDYKVOQZ-UHFFFAOYSA-NBDBM501654198-{2-[4-(3,4-Difluoro-phenyl)-piperazin-1-yl]-ethyl}-8-aza-spiro[4.5]decane-7,9-dione8-{2-[4-(3,4-Difluorophenyl)piperazin-1-yl]ethyl}-8-azaspiro[4.5]decane-7,9-dione
Database identifiers
- PubChem CID
- 9865254
- ChEMBL
CHEMBL192099
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 43.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 568
Related reactions
1 records
Compound notes
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