Basic information
- CAS
67547-91-5- Standard SMILES
CCCCOc1cc(C(=O)NCCN2CCCC2)c2ccccc2n1- InChIKey
FJPJHMFAKBKUMJ-UHFFFAOYSA-N- Molecular formula
- C20H27N3O2
- Average molar mass
- 341.4 g/mol
- Monoisotopic mass
- 341.21032711
Names & identifiers
- Preferred name
- Cinchoninamide, 2-butoxy-N-(2-(1-pyrrolidinyl)ethyl)-
- IUPAC
- 2-butoxy-N-(2-pyrrolidin-1-ylethyl)quinoline-4-carboxamide
Names & synonyms
BRN 0430400Cinchoninamide, 2-butoxy-N-(2-(1-pyrrolidinyl)ethyl)-2-Butoxy-N-(2-(1-pyrrolidinyl)ethyl)cinchoninamide67547-91-54-Quinolinecarboxamide, 2-butoxy-N-(2-(1-pyrrolidinyl)ethyl)-DTXSID00217878RefChem:334140DTXCID50140369CHEMBL4765004SCHEMBL283392672-Butoxy-N-[2-(pyrrolidin-1-yl)ethyl]quinoline-4-carboxamide
Database identifiers
- CAS
67547-91-5- PubChem CID
- 3051612
- DTXSID
DTXSID00217878- ChEMBL
CHEMBL4765004
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 54.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 412
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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