CID 215399

4-chloro-n-(1-(2-(2-methyl-1h-indol-3-yl)ethyl)-4-piperidinyl)benzamide hydrochloride

Structural Information

Molecular Formula
C23H26ClN3O
SMILES
CC1=C(C2=CC=CC=C2N1)CCN3CCC(CC3)NC(=O)C4=CC=C(C=C4)Cl
InChI
InChI=1S/C23H26ClN3O/c1-16-20(21-4-2-3-5-22(21)25-16)12-15-27-13-10-19(11-14-27)26-23(28)17-6-8-18(24)9-7-17/h2-9,19,25H,10-15H2,1H3,(H,26,28)
InChIKey
CZGWQZWVRXSHSC-UHFFFAOYSA-N
Compound name
4-chloro-N-[1-[2-(2-methyl-1H-indol-3-yl)ethyl]piperidin-4-yl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

395.17645 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 396.18373 196.7
[M+Na]+ 418.16567 202.8
[M-H]- 394.16917 202.5
[M+NH4]+ 413.21027 207.5
[M+K]+ 434.13961 193.9
[M+H-H2O]+ 378.17371 186.4
[M+HCOO]- 440.17465 208.4
[M+CH3COO]- 454.19030 204.5
[M+Na-2H]- 416.15112 196.0
[M]+ 395.17590 195.3
[M]- 395.17700 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