Spiro[piperidine-3,3a(2)(4a(2)H)-pyrazino[2,1-c][1,4]oxazine]-1-carboxylic acid, hexahydro-, 1,1-dimethylethyl ester
Basic information
- CAS
1273562-77-8- Standard SMILES
CC(C)(C)OC(=O)N1CCCC2(C1)CN1CCNCC1CO2- InChIKey
NHKUKMDFVOTOBV-UHFFFAOYSA-N- Molecular formula
- C16H29N3O3
- Average molar mass
- 311.42 g/mol
- Monoisotopic mass
- 311.2208918
Names & identifiers
- Preferred name
- Spiro[piperidine-3,3a(2)(4a(2)H)-pyrazino[2,1-c][1,4]oxazine]-1-carboxylic acid, hexahydro-, 1,1-dimethylethyl ester
- IUPAC
- tert-butyl spiro[4,6,7,8,9,9a-hexahydro-1H-pyrazino[2,1-c][1,4]oxazine-3,3'-piperidine]-1'-carboxylate
Names & synonyms
DTXSID9011083071273562-77-8Spiro[piperidine-3,3a(2)(4a(2)H)-pyrazino[2,1-c][1,4]oxazine]-1-carboxylic acid, hexahydro-, 1,1-dimethylethyl ester
Database identifiers
- CAS
1273562-77-8- PubChem CID
- 165367394
- DTXSID
DTXSID901108307
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 54 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 423
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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