Basic information
- CAS
56926-07-9- Standard SMILES
CCOC(=O)N1CCN2C(=O)N(CC)CCC2C1- InChIKey
ZZLFCOKFOFQCAG-UHFFFAOYSA-N- Molecular formula
- C12H21N3O3
- Average molar mass
- 255.31 g/mol
- Monoisotopic mass
- 255.15829154
Names & identifiers
- Preferred name
- Ethyl 7-ethyl-6-oxooctahydro-2h-pyrazino[1,2-c]pyrimidine-2-carboxylate
- IUPAC
- ethyl 7-ethyl-6-oxo-1,3,4,8,9,9a-hexahydropyrazino[1,2-c]pyrimidine-2-carboxylate
Names & synonyms
56926-07-9ethyl 7-ethyl-6-oxooctahydro-2h-pyrazino[1,2-c]pyrimidine-2-carboxylateNSC147955DTXSID80302014NSC-147955
Database identifiers
- CAS
56926-07-9- PubChem CID
- 287802
- DTXSID
DTXSID80302014
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 53.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 335
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…