4-(4-Fluorophenyl)-2,8-diazaspiro[4.5]decan-1-one
Basic information
- CAS
857680-63-8- Standard SMILES
O=C1NCC(c2ccc(F)cc2)C12CCNCC2- InChIKey
ZDMQEPOFLRQVCV-UHFFFAOYSA-N- Molecular formula
- C14H17FN2O
- Average molar mass
- 248.3 g/mol
- Monoisotopic mass
- 248.13249133
Names & identifiers
- Preferred name
- 4-(4-Fluorophenyl)-2,8-diazaspiro[4.5]decan-1-one
- IUPAC
- 4-(4-fluorophenyl)-2,8-diazaspiro[4.5]decan-1-one
Names & synonyms
4-(4-fluorophenyl)-2,8-diazaspiro[4.5]decan-1-one857680-63-8SCHEMBL11383472,8-Diazaspiro[4.5]decan-1-one, 4-(4-fluorophenyl)-DTXSID00469870ZDMQEPOFLRQVCV-UHFFFAOYSA-Nrac-4-(4-fluoro-phenyl)-2,8-diaza-spiro[4.5]decan-1-one
Database identifiers
- CAS
857680-63-8- PubChem CID
- 11639119
- DTXSID
DTXSID00469870
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 41.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 320
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Related reactions
2 records
Compound notes
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