Basic information
- Standard SMILES
CCCC1(C(O)c2ccc3ccccc3n2)CCN(C(=O)OC(C)(C)C)CC1- InChIKey
FXEPLBWSXXIZRI-UHFFFAOYSA-N- Molecular formula
- C23H32N2O3
- Average molar mass
- 384.5 g/mol
Names & identifiers
- Preferred name
- 4-(Hydroxy-quinolin-2-yl-methyl)-4-propyl-piperidine-1-carboxylic acid tert-butyl ester
- IUPAC
- tert-butyl 4-[hydroxy(quinolin-2-yl)methyl]-4-propylpiperidine-1-carboxylate
Names & synonyms
SCHEMBL415615FXEPLBWSXXIZRI-UHFFFAOYSA-N4-(hydroxy-quinolin-2-yl-methyl)-4-propyl-piperidine-1-carboxylic acid tert-butyl ester
Database identifiers
- PubChem CID
- 58017288
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 62.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 522
Related reactions
6 records
Compound notes
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