Basic information
- CAS
24269-88-3- Standard SMILES
CC(C)(C)NCCN1CCN(C(=O)OC2CCCCC2)CC1.Cl- InChIKey
MSYKKASKYJKNFK-UHFFFAOYSA-N- Molecular formula
- C17H34ClN3O2
- Average molar mass
- 347.9 g/mol
- Monoisotopic mass
- 347.233955
Names & identifiers
- Preferred name
- 1-Piperazinecarboxylic acid, 4-(2-(tert-butylamino)ethyl)-, cyclohexyl ester, hydrochloride
- IUPAC
- cyclohexyl 4-[2-(tert-butylamino)ethyl]piperazine-1-carboxylate;hydrochloride
Names & synonyms
24269-88-31-Piperazinecarboxylic acid, 4-(2-(tert-butylamino)ethyl)-, cyclohexyl ester, hydrochloride4-(2-(tert-Butylamino)ethyl)-1-piperazinecarboxylic acid cyclohexyl ester hydrochlorideDTXSID80179006RefChem:233625DTXCID70101497Cyclohexyl 4-[2-(tert-butylamino)ethyl]piperazine-1-carboxylate--hydrogen chloride (1/1)
Database identifiers
- CAS
24269-88-3- PubChem CID
- 212466
- DTXSID
DTXSID80179006
Properties
Computed structural properties
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 340
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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