CID 11441375

N-cyclopropyl-6-[(6,7-dimethoxyquinolin-4-yl)oxy]naphthalene-1-carboxamide

Structural Information

Molecular Formula
C25H22N2O4
SMILES
COC1=CC2=C(C=CN=C2C=C1OC)OC3=CC4=C(C=C3)C(=CC=C4)C(=O)NC5CC5
InChI
InChI=1S/C25H22N2O4/c1-29-23-13-20-21(14-24(23)30-2)26-11-10-22(20)31-17-8-9-18-15(12-17)4-3-5-19(18)25(28)27-16-6-7-16/h3-5,8-14,16H,6-7H2,1-2H3,(H,27,28)
InChIKey
ZATGFXTWDKIEKC-UHFFFAOYSA-N
Compound name
N-cyclopropyl-6-(6,7-dimethoxyquinolin-4-yl)oxynaphthalene-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

15
Patents

414.15796 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 415.16524 199.3
[M+Na]+ 437.14718 208.9
[M-H]- 413.15068 209.6
[M+NH4]+ 432.19178 205.1
[M+K]+ 453.12112 203.0
[M+H-H2O]+ 397.15522 188.7
[M+HCOO]- 459.15616 220.1
[M+CH3COO]- 473.17181 208.6
[M+Na-2H]- 435.13263 204.3
[M]+ 414.15741 207.0
[M]- 414.15851 207.0
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

patents stripe