(S)-3-(5-Bromopyridin-3-yloxy)-piperidine-1-carboxylic acid tert-butyl ester
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Basic information
- Standard SMILES
CC(C)(C)OC(=O)N1CCC[C@H](Oc2cncc(Br)c2)C1- InChIKey
XHQFJQNLSISENQ-LBPRGKRZSA-N- Molecular formula
- C15H21BrN2O3
- Average molar mass
- 357.24 g/mol
Names & identifiers
- Preferred name
- (S)-3-(5-Bromopyridin-3-yloxy)-piperidine-1-carboxylic acid tert-butyl ester
- IUPAC
- tert-butyl (3S)-3-[(5-bromo-3-pyridinyl)oxy]piperidine-1-carboxylate
Names & synonyms
SCHEMBL14780123XHQFJQNLSISENQ-LBPRGKRZSA-N(S)-3-(5-Bromopyridin-3-yloxy)-piperidine-1-carboxylic acid tert-butyl ester
Database identifiers
- PubChem CID
- 86679136
Properties
Computed structural propertiesFilling in
- XLogP
- 3
- Topological polar surface area
- 51.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 359
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Related reactions
1 records
Compound notes
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