Basic information
- Standard SMILES
CC(C)N1CCN(C(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)CC1- InChIKey
UXUFOKSCQDHIIA-JKSUJKDBSA-N- Molecular formula
- C17H23FN2O
- Average molar mass
- 290.38 g/mol
Names & identifiers
- Preferred name
- trans-[2-(4-Fluorophenyl)cyclopropyl]-(4-isopropylpiperazin-1-yl)methanone
- IUPAC
- [(1R,2R)-2-(4-fluorophenyl)cyclopropyl]-(4-propan-2-ylpiperazin-1-yl)methanone
Names & synonyms
SCHEMBL452593UXUFOKSCQDHIIA-JKSUJKDBSA-Ntrans-[2-(4-Fluorophenyl)cyclopropyl]-(4-isopropylpiperazin-1-yl)methanone
Database identifiers
- PubChem CID
- 25196566
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 23.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 371
Related reactions
2 records
Compound notes
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