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CHEBI:247956 - cinchocaine

Default Structure
ChEBI IDCHEBI:247956
ChEBI Namecinchocaine
Stars
DefinitionA monocarboxylic acid amide that is the 2-(diethylamino)ethyl amide of 2-butoxyquinoline-4-carboxylic acid. One of the most potent and toxic of the long-acting local anesthetics, its parenteral use was restricted to spinal anesthesia. It is now generally only used (usually as the hydrochloride) in creams and ointments and in suppositories for temporary relief of pain and itching associated with skin and anorectal conditions.
Secondary ChEBI IDCHEBI:4500
Last Modified22 February 2017
DownloadsMolfile
FormulaC20H29N3O2
Net Charge0
Average Mass343.471
Monoisotopic Mass343.22598
SMILESCCCCOc1cc(C(=O)NCCN(CC)CC)c2ccccc2n1
InChIInChI=1S/C20H29N3O2/c1-4-7-14-25-19-15-17(16-10-8-9-11-18(16)22-19)20(24)21-12-13-23(5-2)6-3/h8-11,15H,4-7,12-14H2,1-3H3,(H,21,24)
InChIKeyPUFQVTATUTYEAL-UHFFFAOYSA-N
Wikipedia
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Application:
topical anaesthetic  A local anesthetic that is used to numb the surface of a body part.
ChEBI Ontology
Outgoing Relation(s)
cinchocaine (CHEBI:247956) has role topical anaesthetic (CHEBI:48425)
cinchocaine (CHEBI:247956) is a aromatic ether (CHEBI:35618)
cinchocaine (CHEBI:247956) is a monocarboxylic acid amide (CHEBI:29347)
cinchocaine (CHEBI:247956) is a tertiary amino compound (CHEBI:50996)
Incoming Relation(s)
cinchocaine hydrochloride (CHEBI:59735) has part cinchocaine (CHEBI:247956)
IUPAC Name 
2-butoxy-N-[2-(diethylamino)ethyl]quinoline-4-carboxamide
INNs  Source
cinchocaineChEBI
cinchocainumChemIDplus
cincocainioChemIDplus
Synonyms  Source
2-butoxy-N-[2-(diethylamino)ethyl]-4-quinolinecarboxamideNIST Chemistry WebBook
2-butoxy-N-(2-(diethylamino)ethyl)cinchoninamideChemIDplus
2-butoxy-N-(α-diethylaminoethyl)cinchoninamideChemIDplus
2-butoxy-N-(β-diethylaminoethyl)cinchoninamideNIST Chemistry WebBook
2-Butoxy-quinoline-4-carboxylic acid (2-diethylamino-ethyl)-amideChEMBL
2-butoxyquinoline-4-carboxylic acid diethylaminoethylamideChemIDplus
Manual XrefsDatabases
859DrugCentral
C07879KEGG COMPOUND
D00733KEGG DRUG
DB00527DrugBank
DibucaineWikipedia
HMDB0014668HMDB
LSM-6018LINCS
US1825623Patent
Registry NumbersSources
Reaxys:275489Reaxys
CAS:85-79-0NIST Chemistry WebBook
CAS:85-79-0KEGG COMPOUND
CAS:85-79-0ChemIDplus
Citations