CID 24842244

104373-56-0

Structural Information

Molecular Formula
C22H30N4O
SMILES
CC1=CC(=C(C(=C1C)N2CCN(C(C2)C3=CC=CC=N3)CCC(=O)N)C)C
InChI
InChI=1S/C22H30N4O/c1-15-13-16(2)18(4)22(17(15)3)26-12-11-25(10-8-21(23)27)20(14-26)19-7-5-6-9-24-19/h5-7,9,13,20H,8,10-12,14H2,1-4H3,(H2,23,27)
InChIKey
QJKKATXPDGPOTP-UHFFFAOYSA-N
Compound name
3-[2-pyridin-2-yl-4-(2,3,5,6-tetramethylphenyl)piperazin-1-yl]propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

366.24197 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 367.24925 194.8
[M+Na]+ 389.23119 208.4
[M+NH4]+ 384.27579 200.9
[M+K]+ 405.20513 200.7
[M-H]- 365.23469 199.8
[M+Na-2H]- 387.21664 201.3
[M]+ 366.24142 198.1
[M]- 366.24252 198.1
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.