Basic information
- Standard SMILES
O=C(c1ccc(F)c(F)c1)N1CC(OC2CCCCO2)C1- InChIKey
BVIGEEMIXYFJQP-UHFFFAOYSA-N- Molecular formula
- C15H17F2NO3
- Average molar mass
- 297.3 g/mol
- Monoisotopic mass
- 297.11764973
Names & identifiers
- Preferred name
- 1-(3,4-difluorobenzoyl)-3-(tetrahydro-2H-pyran-2-yloxy)azetidine
- IUPAC
- (3,4-difluorophenyl)-[3-(oxan-2-yloxy)azetidin-1-yl]methanone
Names & synonyms
SCHEMBL428038BVIGEEMIXYFJQP-UHFFFAOYSA-N1-(3,4-difluorobenzoyl)-3-(tetrahydro-2H-pyran-2-yloxy)azetidine
Database identifiers
- PubChem CID
- 66683228
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 38.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 376
Related reactions
2 records
Compound notes
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