CID 129930559

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

Structural Information

Molecular Formula
C7H10N4O
SMILES
CC1=NC(=NC=C1C(=O)N)NC
InChI
InChI=1S/C7H10N4O/c1-4-5(6(8)12)3-10-7(9-2)11-4/h3H,1-2H3,(H2,8,12)(H,9,10,11)
InChIKey
YHHMPUVFNNFOQW-UHFFFAOYSA-N
Compound name
4-methyl-2-(methylamino)pyrimidine-5-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

2
Patents

166.08546 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 167.092736 134.8
[M+Na]+ 189.074678 143.4
[M-H]- 165.078184 136.1
[M+NH4]+ 184.119283 152.2
[M+K]+ 205.048618 141.5
[M+H-H2O]+ 149.082720 127.4
[M+HCOO]- 211.083661 158.3
[M+CH3COO]- 225.099311 184.2
[M+Na-2H]- 187.060126 141.1
[M]+ 166.08491142 133.4
[M]- 166.08600858 133.4
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

patents stripe