CID 3044770

4-amino-5-chloro-2-methoxy-n-(1-(1-phenylethyl)-4-piperidinyl)benzamide hydrochloride

Structural Information

Molecular Formula
C21H26ClN3O2
SMILES
CC(C1=CC=CC=C1)N2CCC(CC2)NC(=O)C3=CC(=C(C=C3OC)N)Cl
InChI
InChI=1S/C21H26ClN3O2/c1-14(15-6-4-3-5-7-15)25-10-8-16(9-11-25)24-21(26)17-12-18(22)19(23)13-20(17)27-2/h3-7,12-14,16H,8-11,23H2,1-2H3,(H,24,26)
InChIKey
WPYAZSNCHLWCHU-UHFFFAOYSA-N
Compound name
4-amino-5-chloro-2-methoxy-N-[1-(1-phenylethyl)piperidin-4-yl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

387.17136 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 388.17864 194.0
[M+Na]+ 410.16058 206.3
[M+NH4]+ 405.20518 201.1
[M+K]+ 426.13452 198.8
[M-H]- 386.16408 200.2
[M+Na-2H]- 408.14603 201.2
[M]+ 387.17081 197.7
[M]- 387.17191 197.7
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

No patent data available for this compound.