CID 3157325

N-(3,5-dimethylphenyl)-2-(4-phenylpiperazin-1-yl)acetamide

Structural Information

Molecular Formula
C20H25N3O
SMILES
CC1=CC(=CC(=C1)NC(=O)CN2CCN(CC2)C3=CC=CC=C3)C
InChI
InChI=1S/C20H25N3O/c1-16-12-17(2)14-18(13-16)21-20(24)15-22-8-10-23(11-9-22)19-6-4-3-5-7-19/h3-7,12-14H,8-11,15H2,1-2H3,(H,21,24)
InChIKey
VMRPGXMHYROYIL-UHFFFAOYSA-N
Compound name
N-(3,5-dimethylphenyl)-2-(4-phenylpiperazin-1-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

323.19977 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 324.20705 180.4
[M+Na]+ 346.18899 184.5
[M-H]- 322.19249 186.3
[M+NH4]+ 341.23359 190.9
[M+K]+ 362.16293 179.0
[M+H-H2O]+ 306.19703 169.3
[M+HCOO]- 368.19797 197.4
[M+CH3COO]- 382.21362 212.0
[M+Na-2H]- 344.17444 181.9
[M]+ 323.19922 176.0
[M]- 323.20032 176.0
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.