Completing data — usually done within a minute
Basic information
- CAS
669770-59-6- Standard SMILES
Brc1cnc(OC2CN3CCC2CC3)nc1- InChIKey
VIDWHSWBUCLWDV-UHFFFAOYSA-N- Molecular formula
- C11H14BrN3O
- Average molar mass
- 284.15 g/mol
- Monoisotopic mass
- 283.03202417
Names & identifiers
- Preferred name
- 3-((5-Bromopyrimidin-2-yl)oxy)quinuclidine
- IUPAC
- 3-(5-bromopyrimidin-2-yl)oxy-1-azabicyclo[2.2.2]octane
Names & synonyms
3-((5-bromopyrimidin-2-yl)oxy)quinuclidine669770-59-63-[(5-bromopyrimidin-2-yl)oxy]quinuclidineSCHEMBL1542863DTXSID30610515VIDWHSWBUCLWDV-UHFFFAOYSA-N3-(5-bromopyrimidin-2-yl)oxy-1-azabicyclo[2.2.2]octane3-[(5-Bromopyrimidin-2-yl)oxy]-1-azabicyclo[2.2.2]octane
Database identifiers
- CAS
669770-59-6- PubChem CID
- 21072609
- DTXSID
DTXSID30610515
Properties
Computed structural propertiesFilling in
- XLogP
- 1.8
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 237
Related reactions
17 records
Compound notes
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