Basic information
- CAS
16795-51-0- Standard SMILES
CCCC(=O)NCC#CC[NH+]1CCCCC1.O=C([O-])C(=O)O- InChIKey
WVKASPWUJLIABI-UHFFFAOYSA-N- Molecular formula
- C15H24N2O5
- Average molar mass
- 312.36 g/mol
- Monoisotopic mass
- 312.16852187
Names & identifiers
- Preferred name
- Butyramide, N-(4-piperidino-2-butynyl)-, oxalate (1:1)
- IUPAC
- 2-hydroxy-2-oxoacetate;N-(4-piperidin-1-ium-1-ylbut-2-ynyl)butanamide
Names & synonyms
BUTYRAMIDE, N-(4-PIPERIDINO-2-BUTYNYL)-, OXALATE (1:1)N-(4-Piperidino-2-butynyl)butyramide oxalate (1:1)16795-51-0DTXSID50168447RefChem:331203DTXCID80909381-(4-Butanamidobut-2-yn-1-yl)piperidin-1-ium hydrogen ethanedioate
Database identifiers
- CAS
16795-51-0- PubChem CID
- 28088
- DTXSID
DTXSID50168447
Properties
Computed structural properties
- Topological polar surface area
- 111 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 346
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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