Basic information
- CAS
118989-74-5- Standard SMILES
CS(=O)(=O)O.CS(=O)(=O)O.NC(=O)CN1CCN(C2CCCCC2)CC1- InChIKey
AKXCGTJUZWHXCT-UHFFFAOYSA-N- Molecular formula
- C14H31N3O7S2
- Average molar mass
- 417.5 g/mol
- Monoisotopic mass
- 417.16034268
Names & identifiers
- Preferred name
- 1-Piperazineacetamide, N-cyclohexyl-, dimethanesulfonate
- IUPAC
- 2-(4-cyclohexylpiperazin-1-yl)acetamide;methanesulfonic acid
Names & synonyms
1-Piperazineacetamide, N-cyclohexyl-, dimethanesulfonate118989-74-5RefChem:1056406N-Cyclohexyl-2-(1-piperazinyl)acetamide dimethanesulfonateDTXSID50922829(4-Cyclohexylpiperazin-1-yl)ethanimidic acid--methanesulfonic acid (1/2)2-(4-Cyclohexylpiperazin-1-yl)ethanimidic acid--methanesulfonic acid (1/2)
Database identifiers
- CAS
118989-74-5- PubChem CID
- 3088674
- DTXSID
DTXSID50922829
Properties
Computed structural properties
- Topological polar surface area
- 175 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 3
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 323
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…