Tert-butyl 1'-(2-ethoxycarbonyl-ethyl)-[4,4']bipiperidinyl-1-carboxylate
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Basic information
- Standard SMILES
CCOC(=O)CCN1CCC(C2CCN(C(=O)OC(C)(C)C)CC2)CC1- InChIKey
CAONZIHDOLWHNU-UHFFFAOYSA-N- Molecular formula
- C20H36N2O4
- Average molar mass
- 368.5 g/mol
- Monoisotopic mass
- 368.26750763
Names & identifiers
- Preferred name
- Tert-butyl 1'-(2-ethoxycarbonyl-ethyl)-[4,4']bipiperidinyl-1-carboxylate
- IUPAC
- tert-butyl 4-[1-(3-ethoxy-3-oxopropyl)piperidin-4-yl]piperidine-1-carboxylate
Names & synonyms
SCHEMBL3557924CAONZIHDOLWHNU-UHFFFAOYSA-Ntert-butyl 1'-(2-ethoxycarbonyl-ethyl)-[4,4']bipiperidinyl-1-carboxylatetert. butyl1'-(2-ethoxycarbonyl-ethyl)-[4,4']bipiperidinyl-1-carboxylatetert.butyl 1'-(2-ethoxycarbonyl-ethyl)-[4,4']bipiperidinyl-1-carboxylate
Database identifiers
- PubChem CID
- 68690102
Properties
Computed structural propertiesFilling in
- XLogP
- 2.8
- Topological polar surface area
- 59.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 459
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Related reactions
3 records
Compound notes
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