EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:77457 - 1-butyl-2-[(2,6-dimethylphenyl)carbamoyl]piperidinium

ChEBI IDCHEBI:77457
ChEBI Name1-butyl-2-[(2,6-dimethylphenyl)carbamoyl]piperidinium
Stars
DefinitionAn organic cation that is the conjugate acid of 1-butyl-N-(2,6-dimethylphenyl)piperidine-2-carboxamide, obtained by protonation of the tertiary amino group.
Last Modified24 February 2014
SubmitterSteve
DownloadsMolfile
FormulaC18H29N2O
Net Charge+1
Average Mass289.443
Monoisotopic Mass289.22744
SMILESCCCC[NH+]1CCCCC1C(=O)Nc1c(C)cccc1C
InChIInChI=1S/C18H28N2O/c1-4-5-12-20-13-7-6-11-16(20)18(21)19-17-14(2)9-8-10-15(17)3/h8-10,16H,4-7,11-13H2,1-3H3,(H,19,21)/p+1
InChIKeyLEBVLXFERQHONN-UHFFFAOYSA-O
ChEBI Ontology
Outgoing Relation(s)
1-butyl-2-[(2,6-dimethylphenyl)carbamoyl]piperidinium (CHEBI:77457) is a ammonium ion derivative (CHEBI:35274)
1-butyl-2-[(2,6-dimethylphenyl)carbamoyl]piperidinium (CHEBI:77457) is a organic cation (CHEBI:25697)
1-butyl-2-[(2,6-dimethylphenyl)carbamoyl]piperidinium (CHEBI:77457) is conjugate acid of 1-butyl-N-(2,6-dimethylphenyl)piperidine-2-carboxamide (CHEBI:77431)
Incoming Relation(s)
1-butyl-N-(2,6-dimethylphenyl)piperidine-2-carboxamide hydrochloride (CHEBI:77441) has part 1-butyl-2-[(2,6-dimethylphenyl)carbamoyl]piperidinium (CHEBI:77457)
dextrobupivacaine(1+) (CHEBI:77459) is a 1-butyl-2-[(2,6-dimethylphenyl)carbamoyl]piperidinium (CHEBI:77457)
levobupivacaine(1+) (CHEBI:77458) is a 1-butyl-2-[(2,6-dimethylphenyl)carbamoyl]piperidinium (CHEBI:77457)
1-butyl-N-(2,6-dimethylphenyl)piperidine-2-carboxamide (CHEBI:77431) is conjugate base of 1-butyl-2-[(2,6-dimethylphenyl)carbamoyl]piperidinium (CHEBI:77457)
IUPAC Name 
1-butyl-2-[(2,6-dimethylphenyl)carbamoyl]piperidinium