CID 2873163

N-[1-(2-morpholin-4-yl-ethylcarbamoyl)-2-phenyl-vinyl]-benzamide

Structural Information

Molecular Formula
C22H25N3O3
SMILES
C1COCCN1CCNC(=O)/C(=C/C2=CC=CC=C2)/NC(=O)C3=CC=CC=C3
InChI
InChI=1S/C22H25N3O3/c26-21(19-9-5-2-6-10-19)24-20(17-18-7-3-1-4-8-18)22(27)23-11-12-25-13-15-28-16-14-25/h1-10,17H,11-16H2,(H,23,27)(H,24,26)/b20-17-
InChIKey
XYSWSCBQFFAFRD-JZJYNLBNSA-N
Compound name
N-[(Z)-3-(2-morpholin-4-ylethylamino)-3-oxo-1-phenylprop-1-en-2-yl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

379.1896 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 380.196876 192.2
[M+Na]+ 402.178818 191.6
[M-H]- 378.182324 198.7
[M+NH4]+ 397.223423 198.7
[M+K]+ 418.152758 188.3
[M+H-H2O]+ 362.186860 180.8
[M+HCOO]- 424.187801 208.8
[M+CH3COO]- 438.203451 220.4
[M+Na-2H]- 400.164266 193.9
[M]+ 379.18905142 186.8
[M]- 379.19014858 186.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.