CID 501389

N-[(dipropylamino)methyl]-5-methyl-pyrazine-2-carboxamide

Structural Information

Molecular Formula
C13H22N4O
SMILES
CCCN(CCC)CNC(=O)C1=NC=C(N=C1)C
InChI
InChI=1S/C13H22N4O/c1-4-6-17(7-5-2)10-16-13(18)12-9-14-11(3)8-15-12/h8-9H,4-7,10H2,1-3H3,(H,16,18)
InChIKey
IDOHQQPCGWMZMA-UHFFFAOYSA-N
Compound name
N-[(dipropylamino)methyl]-5-methylpyrazine-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

250.17937 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 251.18665 161.5
[M+Na]+ 273.16859 166.7
[M-H]- 249.17209 163.3
[M+NH4]+ 268.21319 176.2
[M+K]+ 289.14253 165.2
[M+H-H2O]+ 233.17663 152.4
[M+HCOO]- 295.17757 184.2
[M+CH3COO]- 309.19322 204.5
[M+Na-2H]- 271.15404 165.8
[M]+ 250.17882 164.1
[M]- 250.17992 164.1
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

patents stripe