CID 3060993

2(1h)-quinolinone, 4-methyl-7-(3-(4-(phenylmethyl)-1-piperidinyl)propoxy)-

Structural Information

Molecular Formula
C25H30N2O2
SMILES
CC1=CC(=O)NC2=C1C=CC(=C2)OCCCN3CCC(CC3)CC4=CC=CC=C4
InChI
InChI=1S/C25H30N2O2/c1-19-16-25(28)26-24-18-22(8-9-23(19)24)29-15-5-12-27-13-10-21(11-14-27)17-20-6-3-2-4-7-20/h2-4,6-9,16,18,21H,5,10-15,17H2,1H3,(H,26,28)
InChIKey
ZVIURFHDXIMZNQ-UHFFFAOYSA-N
Compound name
7-[3-(4-benzylpiperidin-1-yl)propoxy]-4-methyl-1H-quinolin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

390.23074 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 391.23802 199.8
[M+Na]+ 413.21996 215.2
[M+NH4]+ 408.26456 207.4
[M+K]+ 429.19390 204.9
[M-H]- 389.22346 205.8
[M+Na-2H]- 411.20541 207.8
[M]+ 390.23019 203.8
[M]- 390.23129 203.8
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