Basic information
- CAS
427888-20-8- Standard SMILES
C[C@H]1C(=O)NCC(=O)N1Cc1ccccc1- InChIKey
DFPMKNKHZCCUDR-VIFPVBQESA-N- Molecular formula
- C12H14N2O2
- Average molar mass
- 218.25 g/mol
- Monoisotopic mass
- 218.10552769
Names & identifiers
- Preferred name
- (6S)-1-Benzyl-6-methylpiperazine-2,5-dione
- IUPAC
- (6S)-1-benzyl-6-methylpiperazine-2,5-dione
Names & synonyms
(6S)-1-Benzyl-6-methylpiperazine-2,5-dione427888-20-8DTXSID50785471RefChem:209814DTXCID80736214(s)-1-benzyl-6-methylpiperazine-2,5-dione
Database identifiers
- CAS
427888-20-8- PubChem CID
- 71361815
- DTXSID
DTXSID50785471- Nikkaji
- J2.301.318E
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 49.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 285
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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