Basic information
- CAS
24269-89-4- Standard SMILES
CCCCCNCCN1CCN(C(=O)OC2CCCCC2)CC1.Cl- InChIKey
UOKAOPWKJCHOKD-UHFFFAOYSA-N- Molecular formula
- C18H36ClN3O2
- Average molar mass
- 361.9 g/mol
- Monoisotopic mass
- 361.2496051
Names & identifiers
- Preferred name
- 1-Piperazinecarboxylic acid, 4-(2-(pentylamino)ethyl)-, cyclohexyl ester, hydrochloride
- IUPAC
- cyclohexyl 4-[2-(pentylamino)ethyl]piperazine-1-carboxylate;hydrochloride
Names & synonyms
24269-89-41-Piperazinecarboxylic acid, 4-(2-(pentylamino)ethyl)-, cyclohexyl ester, hydrochloride4-(2-(Pentylamino)ethyl)-1-piperazinecarboxylic acid cyclohexyl ester hydrochlorideDTXSID40179007RefChem:233622DTXCID30101498Cyclohexyl 4-[2-(pentylamino)ethyl]piperazine-1-carboxylate--hydrogen chloride (1/1)
Database identifiers
- CAS
24269-89-4- PubChem CID
- 212468
- DTXSID
DTXSID40179007
Properties
Computed structural properties
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 324
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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