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N-Isobutyl-tetradeca-2,4-dienamide
PHCD compound ID : 5469
Chemical Names :
N-Isobutyl-tetradeca-2,4-dienamide
Molecular Formula : C18H33N1O1
Molecular Weight : 279.256215
More Details :
Names & Synonyms: (2E,4E)-N-isobutyltetradeca-2,4-dienamide , (2E,4E)-N-(2-methylpropyl)tetradeca-2,4-dienamide , (2E,4E)-N-(2-methylpropyl)tetradeca-2,4-dienamide
Smiles: CCCCCCCCC/C=C/C=C/C(=O)NCC(C)C
InChi : InChI=1S/C18H33NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-18(20)19-16-17(2)3/h12-15,17H,4-11,16H2,1-3H3,(H,19,20)/b13-12+,15-14+
InChi Key : InChIKey=AGJAUFUNZWHLKE-SQIWNDBBSA-N
PubChem ID : 10731388
Rotatable bond count : 13 Rule of five : 2
Hydrogen bond acceptor count : 2 Ionization potential : 9.306061
Hydrogen bond donor count : 1 Electric dipole moment : 3.438
XLogP : 6.745 VDW volume : 331.761793
Molecular weight : 279.256215 HOMO-LUMO gap : 8.907000
Herb list :
Refrences & Litretures:
  
911.      Journal:'Indian Journal of Pharmaceutical Education and Research'      Year:'2017'      Volume:'51'      Page:'S244'      DOI:'10.5530/ijper.51.3s.22'      Title:'Antimicrobial Activity and Chemical Composition Screening of Anacyclus pyrethrum Root'
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