Basic information
- CAS
24269-87-2- Standard SMILES
CC(C)CNCCN1CCN(C(=O)OC2CCCCC2)CC1.Cl- InChIKey
DQQJZKGHUQWXKK-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-(isobutylamino)ethyl)-, cyclohexyl ester, hydrochloride
- IUPAC
- cyclohexyl 4-[2-(2-methylpropylamino)ethyl]piperazine-1-carboxylate;hydrochloride
Names & synonyms
24269-87-21-Piperazinecarboxylic acid, 4-(2-(isobutylamino)ethyl)-, cyclohexyl ester, hydrochloride4-(2-(Isobutylamino)ethyl)-1-piperazinecarboxylic acid cyclohexyl ester hydrochlorideDTXSID20179005RefChem:233614DTXCID10101496Cyclohexyl 4-{2-[(2-methylpropyl)amino]ethyl}piperazine-1-carboxylate--hydrogen chloride (1/1)
Database identifiers
- CAS
24269-87-2- PubChem CID
- 212464
- DTXSID
DTXSID20179005
Properties
Computed structural properties
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 322
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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