Basic information
- Standard SMILES
C=CCCC(NC(C)=O)(C(=O)NC(C)(C)C)C1CCNCC1.Cl- InChIKey
IMTMILGMOKWFHG-UHFFFAOYSA-N- Molecular formula
- C17H32ClN3O2
- Average molar mass
- 345.9 g/mol
- Monoisotopic mass
- 345.218305
Names & identifiers
- Preferred name
- 2-Acetylamino-2-piperidin-4-yl-hex-5-enoic acid tert-butylamide hydrochloride
- IUPAC
- 2-acetamido-N-tert-butyl-2-piperidin-4-ylhex-5-enamide;hydrochloride
Names & synonyms
SCHEMBL895688IMTMILGMOKWFHG-UHFFFAOYSA-N2-acetylamino-2-piperidin-4-yl-hex-5-enoic acid tert-butylamide hydrochloride
Database identifiers
- PubChem CID
- 66833574
Properties
Computed structural properties
- Topological polar surface area
- 70.2 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 409
Related reactions
1 records
Compound notes
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