Basic information
- Standard SMILES
CCc1cnc(N2CCC(N3CCC[C@H](NC)C3=O)CC2)nc1- InChIKey
GSWZJQXEYUEHNO-HNNXBMFYSA-N- Molecular formula
- C17H27N5O
- Average molar mass
- 317.4 g/mol
Names & identifiers
- Preferred name
- (S)-1'-(5-ethylpyrimidin-2-yl)-3-(methylamino)-1,4'-bipiperidin-2-one
- IUPAC
- (3S)-1-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]-3-(methylamino)piperidin-2-one
Names & synonyms
SCHEMBL2598818GSWZJQXEYUEHNO-HNNXBMFYSA-N(S)-1'-(5-ethylpyrimidin-2-yl)-3-(methylamino)-1,4'-bipiperidin-2-one
Database identifiers
- PubChem CID
- 67470730
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 61.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 388
Related reactions
2 records
Compound notes
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