CID 45051424

853333-47-8

Structural Information

Molecular Formula
C22H25N3O2
SMILES
COC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)NCCN4CCOCC4
InChI
InChI=1S/C22H25N3O2/c1-26-18-8-6-17(7-9-18)21-16-22(19-4-2-3-5-20(19)24-21)23-10-11-25-12-14-27-15-13-25/h2-9,16H,10-15H2,1H3,(H,23,24)
InChIKey
LBLDTKUXWPRTDL-UHFFFAOYSA-N
Compound name
2-(4-methoxyphenyl)-N-(2-morpholin-4-ylethyl)quinolin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

363.19467 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 364.20195 190.7
[M+Na]+ 386.18389 206.0
[M+NH4]+ 381.22849 198.8
[M+K]+ 402.15783 196.6
[M-H]- 362.18739 199.0
[M+Na-2H]- 384.16934 199.5
[M]+ 363.19412 195.3
[M]- 363.19522 195.3
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

patents stripe