CID 2756655

N-benzyl-2-(piperazin-1-yl)acetamide

Structural Information

Molecular Formula
C13H19N3O
SMILES
C1CN(CCN1)CC(=O)NCC2=CC=CC=C2
InChI
InChI=1S/C13H19N3O/c17-13(11-16-8-6-14-7-9-16)15-10-12-4-2-1-3-5-12/h1-5,14H,6-11H2,(H,15,17)
InChIKey
PEFLHMLMYGIRGW-UHFFFAOYSA-N
Compound name
N-benzyl-2-piperazin-1-ylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

25
Patents

233.15282 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 234.16010 154.9
[M+Na]+ 256.14204 157.6
[M-H]- 232.14554 155.9
[M+NH4]+ 251.18664 168.1
[M+K]+ 272.11598 153.6
[M+H-H2O]+ 216.15008 145.7
[M+HCOO]- 278.15102 171.6
[M+CH3COO]- 292.16667 189.1
[M+Na-2H]- 254.12749 159.5
[M]+ 233.15227 147.8
[M]- 233.15337 147.8
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

patents stripe