CID 207559

Benzamide, 4-amino-3-methyl-n-(2-(4-(2-pyridinyl)-1-piperazinyl)ethyl)-

Structural Information

Molecular Formula
C19H25N5O
SMILES
CC1=C(C=CC(=C1)C(=O)NCCN2CCN(CC2)C3=CC=CC=N3)N
InChI
InChI=1S/C19H25N5O/c1-15-14-16(5-6-17(15)20)19(25)22-8-9-23-10-12-24(13-11-23)18-4-2-3-7-21-18/h2-7,14H,8-13,20H2,1H3,(H,22,25)
InChIKey
LWETYXMXECUSKZ-UHFFFAOYSA-N
Compound name
4-amino-3-methyl-N-[2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

339.2059 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 340.21318 183.9
[M+Na]+ 362.19512 187.6
[M-H]- 338.19862 188.1
[M+NH4]+ 357.23972 191.8
[M+K]+ 378.16906 181.8
[M+H-H2O]+ 322.20316 172.0
[M+HCOO]- 384.20410 200.4
[M+CH3COO]- 398.21975 216.5
[M+Na-2H]- 360.18057 185.9
[M]+ 339.20535 178.2
[M]- 339.20645 178.2
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