Ketone, 1-adamantyl piperidinomethyl, hydrochloride
Basic information
- CAS
23479-47-2- Standard SMILES
Cl.O=C(CN1CCCCC1)C12CC3CC(CC(C3)C1)C2- InChIKey
JAPQLDFOGYVHMQ-UHFFFAOYSA-N- Molecular formula
- C17H28ClNO
- Average molar mass
- 297.9 g/mol
- Monoisotopic mass
- 297.1859422
Names & identifiers
- Preferred name
- Ketone, 1-adamantyl piperidinomethyl, hydrochloride
- IUPAC
- 1-(1-adamantyl)-2-piperidin-1-ylethanone;hydrochloride
Names & synonyms
KETONE, 1-ADAMANTYL PIPERIDINOMETHYL, HYDROCHLORIDE1-Adamantyl piperidinomethyl ketone hydrochloride23479-47-2DTXSID80178039RefChem:350384DTXCID601005301-(Adamantan-1-yl)-2-(piperidin-1-yl)ethan-1-one--hydrogen chloride (1/1)
Database identifiers
- CAS
23479-47-2- PubChem CID
- 31941
- DTXSID
DTXSID80178039
Properties
Computed structural properties
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 328
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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