Basic information
- Standard SMILES
CC(C)(C)CC(=O)N1CCC2(CC1)CCN(c1ccc(C(O)C(C)(F)F)cc1)C2=O- InChIKey
TVRXVWBJQORIIM-UHFFFAOYSA-N- Molecular formula
- C23H32F2N2O3
- Average molar mass
- 422.5 g/mol
Names & identifiers
- Preferred name
- 2-(4-(2,2-Difluoro-1-hydroxypropyl)phenyl)-8-(3,3-dimethylbutanoyl)-2,8-diazaspiro[4.5]decan-1-one
- IUPAC
- 2-[4-(2,2-difluoro-1-hydroxypropyl)phenyl]-8-(3,3-dimethylbutanoyl)-2,8-diazaspiro[4.5]decan-1-one
Names & synonyms
2-(4-(2,2-difluoro-1-hydroxypropyl)phenyl)-8-(3,3-dimethylbutanoyl)-2,8-diazaspiro[4.5]decan-1-oneSCHEMBL3748442
Database identifiers
- PubChem CID
- 59577905
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 60.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 645
Related reactions
2 records
Compound notes
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