Basic information
- Standard SMILES
CC(C)(C)OC(=O)NN1CCC2(CC2(F)F)c2ccccc21- InChIKey
JPFGQEBJFPWIPM-UHFFFAOYSA-N- Molecular formula
- C16H20F2N2O2
- Average molar mass
- 310.34 g/mol
- Monoisotopic mass
- 310.14928421
Names & identifiers
- Preferred name
- tert-butyl 2,2-difluoro-2',3'-dihydro-1'H-spiro[cyclopropane-1,4'-quinoline]-1'-carbamate
- IUPAC
- tert-butyl N-(1',1'-difluorospiro[2,3-dihydroquinoline-4,2'-cyclopropane]-1-yl)carbamate
Names & synonyms
tert-butyl 2,2-difluoro-2',3'-dihydro-1'H-spiro[cyclopropane-1,4'-quinoline]-1'-carbamateSCHEMBL1865623
Database identifiers
- PubChem CID
- 67192015
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 41.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 464
Related reactions
2 records
Compound notes
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