CID 3069110

84332-19-4

Structural Information

Molecular Formula
C14H23N5O2
SMILES
CCN1CCCCC1CNC(=O)C2=CN=C(N=C2OC)N
InChI
InChI=1S/C14H23N5O2/c1-3-19-7-5-4-6-10(19)8-16-12(20)11-9-17-14(15)18-13(11)21-2/h9-10H,3-8H2,1-2H3,(H,16,20)(H2,15,17,18)
InChIKey
QDZFOCNKTLRUNL-UHFFFAOYSA-N
Compound name
2-amino-N-[(1-ethylpiperidin-2-yl)methyl]-4-methoxypyrimidine-5-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

293.18518 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 294.19246 171.5
[M+Na]+ 316.17440 176.1
[M-H]- 292.17790 173.0
[M+NH4]+ 311.21900 181.9
[M+K]+ 332.14834 172.8
[M+H-H2O]+ 276.18244 161.2
[M+HCOO]- 338.18338 188.6
[M+CH3COO]- 352.19903 207.8
[M+Na-2H]- 314.15985 173.4
[M]+ 293.18463 168.1
[M]- 293.18573 168.1
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.