Basic information
- Standard SMILES
CC(C)(C)OC(=O)Nc1ccc(C(=O)CC2(O)CCN(Cc3ccccc3)CC2)cc1- InChIKey
XTCYZTJFSSLVRF-UHFFFAOYSA-N- Molecular formula
- C25H32N2O4
- Average molar mass
- 424.5 g/mol
- Monoisotopic mass
- 424.23620751
Names & identifiers
- Preferred name
- N-t-butoxycarbonyl-4-[(1-benzyl-4-hydroxypiperidin-4-yl)acetyl]aniline
- IUPAC
- tert-butyl N-[4-[2-(1-benzyl-4-hydroxypiperidin-4-yl)acetyl]phenyl]carbamate
Names & synonyms
SCHEMBL8117630XTCYZTJFSSLVRF-UHFFFAOYSA-NN-t-butoxycarbonyl-4-[(1-benzyl-4-hydroxypiperidin-4-yl)acetyl]aniline
Database identifiers
- PubChem CID
- 19968906
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 78.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 593
Related reactions
2 records
Compound notes
Loading…