CID 3052573

1-piperidineacetamide, n-(((4-chlorophenyl)amino)carbonyl)-4-phenyl-

Structural Information

Molecular Formula
C20H22ClN3O2
SMILES
C1CN(CCC1C2=CC=CC=C2)CC(=O)NC(=O)NC3=CC=C(C=C3)Cl
InChI
InChI=1S/C20H22ClN3O2/c21-17-6-8-18(9-7-17)22-20(26)23-19(25)14-24-12-10-16(11-13-24)15-4-2-1-3-5-15/h1-9,16H,10-14H2,(H2,22,23,25,26)
InChIKey
SSBFDTKBACRRDL-UHFFFAOYSA-N
Compound name
N-[(4-chlorophenyl)carbamoyl]-2-(4-phenylpiperidin-1-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

371.14005 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 372.14733 187.8
[M+Na]+ 394.12927 190.8
[M-H]- 370.13277 194.6
[M+NH4]+ 389.17387 197.9
[M+K]+ 410.10321 184.8
[M+H-H2O]+ 354.13731 177.8
[M+HCOO]- 416.13825 202.1
[M+CH3COO]- 430.15390 217.9
[M+Na-2H]- 392.11472 189.0
[M]+ 371.13950 184.4
[M]- 371.14060 184.4
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.