Basic information
- Standard SMILES
CC(C)C(=O)Nc1cccc(C2CCN(CCCC(=O)c3ccc(C(C)(C)C)cc3)CC2)c1- InChIKey
SMCGATVBDGRGEA-UHFFFAOYSA-N- Molecular formula
- C29H40N2O2
- Average molar mass
- 448.6 g/mol
Names & identifiers
- Preferred name
- N-(3-{1-[4-(4-Tert-butylphenyl)-4-oxobutyl]-4-piperidinyl}phenyl)-2-methylpropanamide
- IUPAC
- N-[3-[1-[4-(4-tert-butylphenyl)-4-oxobutyl]piperidin-4-yl]phenyl]-2-methylpropanamide
Names & synonyms
SCHEMBL5660302SMCGATVBDGRGEA-UHFFFAOYSA-NN-(3-{1-[4-(4-TERT-BUTYLPHENYL)-4-OXOBUTYL]-4-PIPERIDINYL}PHENYL)-2-METHYLPROPANAMIDE
Database identifiers
- PubChem CID
- 22049598
Properties
Computed structural properties
- XLogP
- 6.1
- Topological polar surface area
- 49.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 9
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 622
Related reactions
3 records
Compound notes
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