CID 112692990

4-amino-2-(methylamino)pyrimidine-5-carboxamide

Structural Information

Molecular Formula
C6H9N5O
SMILES
CNC1=NC=C(C(=N1)N)C(=O)N
InChI
InChI=1S/C6H9N5O/c1-9-6-10-2-3(5(8)12)4(7)11-6/h2H,1H3,(H2,8,12)(H3,7,9,10,11)
InChIKey
VMUKAXPKUFNYLB-UHFFFAOYSA-N
Compound name
4-amino-2-(methylamino)pyrimidine-5-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

167.0807 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.08798 133.2
[M+Na]+ 190.06992 142.7
[M+NH4]+ 185.11452 139.2
[M+K]+ 206.04386 139.3
[M-H]- 166.07342 134.3
[M+Na-2H]- 188.05537 138.4
[M]+ 167.08015 134.3
[M]- 167.08125 134.3
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