CID 6048959

2-[4-(2-chlorobenzyl)piperazin-1-yl]-n'-[(1z)-1-(pyridin-3-yl)ethylidene]acetohydrazide

Structural Information

Molecular Formula
C20H24ClN5O
SMILES
C/C(=N/NC(=O)CN1CCN(CC1)CC2=CC=CC=C2Cl)/C3=CN=CC=C3
InChI
InChI=1S/C20H24ClN5O/c1-16(17-6-4-8-22-13-17)23-24-20(27)15-26-11-9-25(10-12-26)14-18-5-2-3-7-19(18)21/h2-8,13H,9-12,14-15H2,1H3,(H,24,27)/b23-16-
InChIKey
OJMMFQAUGAEHRY-KQWNVCNZSA-N
Compound name
2-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]-N-[(Z)-1-pyridin-3-ylethylideneamino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

385.16693 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 386.17421 191.9
[M+Na]+ 408.15615 204.5
[M+NH4]+ 403.20075 198.2
[M+K]+ 424.13009 196.4
[M-H]- 384.15965 197.2
[M+Na-2H]- 406.14160 200.4
[M]+ 385.16638 195.2
[M]- 385.16748 195.2
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.