CID 10425450

1347744-96-0

Structural Information

Molecular Formula
C19H23N3O
SMILES
CC1=CC(=CC=C1)NC(=O)CN2CCC(CC2)C3=CC=CC=N3
InChI
InChI=1S/C19H23N3O/c1-15-5-4-6-17(13-15)21-19(23)14-22-11-8-16(9-12-22)18-7-2-3-10-20-18/h2-7,10,13,16H,8-9,11-12,14H2,1H3,(H,21,23)
InChIKey
JFCDMGGMCUKHST-UHFFFAOYSA-N
Compound name
N-(3-methylphenyl)-2-(4-pyridin-2-ylpiperidin-1-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

15
References

75
Patents

309.1841 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 310.191376 175.5
[M+Na]+ 332.173318 179.0
[M-H]- 308.176824 181.1
[M+NH4]+ 327.217923 186.2
[M+K]+ 348.147258 173.8
[M+H-H2O]+ 292.181360 164.3
[M+HCOO]- 354.182301 192.8
[M+CH3COO]- 368.197951 184.2
[M+Na-2H]- 330.158766 178.3
[M]+ 309.18355142 170.3
[M]- 309.18464858 170.3
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