Basic information
- Standard SMILES
CCc1cnc(N2CC[C@H](NC3CC3)[C@H](F)C2)nc1- InChIKey
KDNJVBKUIXRWTN-OLZOCXBDSA-N- Molecular formula
- C14H21FN4
- Average molar mass
- 264.34 g/mol
Names & identifiers
- Preferred name
- (3R,4S)-Cyclopropyl-[1-(5-ethyl-pyrimidin-2-yl)-3-fluoro-piperidin-4-yl]-amine
- IUPAC
- (3R,4S)-N-cyclopropyl-1-(5-ethylpyrimidin-2-yl)-3-fluoropiperidin-4-amine
Names & synonyms
SCHEMBL12491852KDNJVBKUIXRWTN-OLZOCXBDSA-N(3R,4S)-Cyclopropyl-[1-(5-ethyl-pyrimidin-2-yl)-3-fluoro-piperidin-4-yl]-amine
Database identifiers
- PubChem CID
- 68290756
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 41.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 289
Related reactions
1 records
Compound notes
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