CID 6445012

(+-)-n5,n5-diethyl-n1,n1-dipropyl-2-((3-(2-furanyl)-1-oxo-2-propyl)amino)pentanediamide

Structural Information

Molecular Formula
C22H35N3O4
SMILES
CCCN(CCC)C(=O)C(CCC(=O)N(CC)CC)NC(=O)/C=C/C1=CC=CO1
InChI
InChI=1S/C22H35N3O4/c1-5-15-25(16-6-2)22(28)19(12-14-21(27)24(7-3)8-4)23-20(26)13-11-18-10-9-17-29-18/h9-11,13,17,19H,5-8,12,14-16H2,1-4H3,(H,23,26)/b13-11+
InChIKey
TYZNAYCPGCUADZ-ACCUITESSA-N
Compound name
N',N'-diethyl-2-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]-N,N-dipropylpentanediamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

405.26276 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 406.27004 205.2
[M+Na]+ 428.25198 208.1
[M+NH4]+ 423.29658 207.6
[M+K]+ 444.22592 206.9
[M-H]- 404.25548 205.7
[M+Na-2H]- 426.23743 204.1
[M]+ 405.26221 204.9
[M]- 405.26331 204.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.