2,6-Dimethyl-2,6-bis(2-methylpropyl)-3-(propan-2-yl)piperidin-4-one
Basic information
- CAS
62810-74-6- Standard SMILES
CC(C)CC1(C)CC(=O)C(C(C)C)C(C)(CC(C)C)N1- InChIKey
YFUJARPCCPLRKM-UHFFFAOYSA-N- Molecular formula
- C18H35NO
- Average molar mass
- 281.5 g/mol
- Monoisotopic mass
- 281.27186474
Names & identifiers
- Preferred name
- 2,6-Dimethyl-2,6-bis(2-methylpropyl)-3-(propan-2-yl)piperidin-4-one
- IUPAC
- 2,6-dimethyl-2,6-bis(2-methylpropyl)-3-propan-2-ylpiperidin-4-one
Names & synonyms
62810-74-6SCHEMBL11532228DTXSID806125442,6-Dimethyl-2,6-bis(2-methylpropyl)-3-(propan-2-yl)piperidin-4-one
Database identifiers
- CAS
62810-74-6- PubChem CID
- 21330438
- DTXSID
DTXSID80612544
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 347
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Compound notes
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