LYT

BUTYLAMINE

Created:1999-07-08
Last modified:  2024-09-27

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Chemical Details

Formal Charge0
Atom Count16
Chiral Atom Count0
Bond Count15
Aromatic Bond Count0
2D diagram of LYT

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Chemical Component Summary

NameBUTYLAMINE
Systematic Name (OpenEye OEToolkits)butan-1-amine
FormulaC4 H11 N
Molecular Weight73.137
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04NCCCC
SMILESCACTVS3.341CCCCN
SMILESOpenEye OEToolkits1.5.0CCCCN
Canonical SMILESCACTVS3.341 CCCCN
Canonical SMILESOpenEye OEToolkits1.5.0 CCCCN
InChIInChI1.03 InChI=1S/C4H11N/c1-2-3-4-5/h2-5H2,1H3
InChIKeyInChI1.03 HQABUPZFAYXKJW-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank data are sourced from datasets licensed under a Creative Common's Attribution-NonCommercial 4.0 International License
DrugBank IDDB03659 
NameButylamine
Groups experimental
DescriptionButylamine is a colourless liquid which acquires a yellow colour upon storage in air. It is one of the four isomeric amines of butane. It is known to have the fishy, ammonia-like odor common to amines.
Synonyms
  • 1-butanamine
  • 1-aminobutane
  • Butylamine
  • n-butylamine
Categories
  • Alkanes
  • Amines
  • Butanes
  • Hydrocarbons, Acyclic
CAS number109-73-9

Drug Targets

DrugBank data are sourced from datasets licensed under a Creative Common's Attribution-NonCommercial 4.0 International License
NameTarget SequencePharmacological ActionActions
Candidapepsin-2MFLKNIFIALAIALLVDATPTTTKRSAGFVALDFSVVKTPKAFPVTNGQE...unknown
Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682

Related Resource References

Resource NameReference
PubChem 8007
ChEMBL CHEMBL13968
ChEBI CHEBI:43799
CCDC/CSD DAQXUO, HEYNOR, DAQXUO01, HEYNOR06, HEYNOR02, HEYNOR03, HEYNOR04, HEYNOR05, DEMCOO, ALEROZ, CIKLUE, DAYWUY, CONTEH04, BUCQEV, BOPTAE, FUDKEX03, FUDKEX, CONTEH, AZAWEF, CONTEH03, FUDKEX02, GAPHIR01
COD 7214421