CID 2813152

Mls000860452

Structural Information

Molecular Formula
C19H23N3O2
SMILES
CN1CCN(CC1)CC(=O)NC2=CC=CC=C2OC3=CC=CC=C3
InChI
InChI=1S/C19H23N3O2/c1-21-11-13-22(14-12-21)15-19(23)20-17-9-5-6-10-18(17)24-16-7-3-2-4-8-16/h2-10H,11-15H2,1H3,(H,20,23)
InChIKey
GKRKJKAVJFQUNM-UHFFFAOYSA-N
Compound name
2-(4-methylpiperazin-1-yl)-N-(2-phenoxyphenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

9
References

0
Patents

325.17902 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 326.186296 178.3
[M+Na]+ 348.168238 181.7
[M-H]- 324.171744 184.0
[M+NH4]+ 343.212843 188.3
[M+K]+ 364.142178 177.1
[M+H-H2O]+ 308.176280 166.9
[M+HCOO]- 370.177221 195.9
[M+CH3COO]- 384.192871 210.0
[M+Na-2H]- 346.153686 181.2
[M]+ 325.17847142 174.5
[M]- 325.17956858 174.5
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.