CID 215405

N-(1-(1h-indol-3-ylmethyl)-4-piperidinyl)benzamide hydrochloride

Structural Information

Molecular Formula
C21H23N3O
SMILES
C1CN(CCC1NC(=O)C2=CC=CC=C2)CC3=CNC4=CC=CC=C43
InChI
InChI=1S/C21H23N3O/c25-21(16-6-2-1-3-7-16)23-18-10-12-24(13-11-18)15-17-14-22-20-9-5-4-8-19(17)20/h1-9,14,18,22H,10-13,15H2,(H,23,25)
InChIKey
COHKYVJQKVWPFK-UHFFFAOYSA-N
Compound name
N-[1-(1H-indol-3-ylmethyl)piperidin-4-yl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

333.1841 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 334.191376 178.5
[M+Na]+ 356.173318 182.9
[M-H]- 332.176824 184.3
[M+NH4]+ 351.217923 190.4
[M+K]+ 372.147258 175.9
[M+H-H2O]+ 316.181360 168.0
[M+HCOO]- 378.182301 195.7
[M+CH3COO]- 392.197951 187.1
[M+Na-2H]- 354.158766 181.1
[M]+ 333.18355142 173.3
[M]- 333.18464858 173.3
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

No patent data available for this compound.