1-Piperazinecarboxylic acid, 4-(2-(diisobutylamino)ethyl)-, isobutyl ester, hydrochloride
Basic information
- CAS
24269-79-2- Standard SMILES
CC(C)COC(=O)N1CCN(CCN(CC(C)C)CC(C)C)CC1.Cl- InChIKey
ANGBBZOWVCMTFF-UHFFFAOYSA-N- Molecular formula
- C19H40ClN3O2
- Average molar mass
- 378 g/mol
- Monoisotopic mass
- 377.2809052
Names & identifiers
- Preferred name
- 1-Piperazinecarboxylic acid, 4-(2-(diisobutylamino)ethyl)-, isobutyl ester, hydrochloride
- IUPAC
- 2-methylpropyl 4-[2-[bis(2-methylpropyl)amino]ethyl]piperazine-1-carboxylate;hydrochloride
Names & synonyms
24269-79-21-Piperazinecarboxylic acid, 4-(2-(diisobutylamino)ethyl)-, isobutyl ester, hydrochloride4-(2-(Diisobutylamino)ethyl)-1-piperazinecarboxylic acid isobutyl ester hydrochlorideDTXSID80178998RefChem:233604DTXCID401014892-Methylpropyl 4-{2-[bis(2-methylpropyl)amino]ethyl}piperazine-1-carboxylate--hydrogen chloride (1/1)
Database identifiers
- CAS
24269-79-2- PubChem CID
- 212448
- DTXSID
DTXSID80178998
Properties
Computed structural properties
- Topological polar surface area
- 36 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 10
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 341
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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