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]+ 294.192456 171.5
[M+Na]+ 316.174398 176.1
[M-H]- 292.177904 173.0
[M+NH4]+ 311.219003 181.9
[M+K]+ 332.148338 172.8
[M+H-H2O]+ 276.182440 161.2
[M+HCOO]- 338.183381 188.6
[M+CH3COO]- 352.199031 207.8
[M+Na-2H]- 314.159846 173.4
[M]+ 293.18463142 168.1
[M]- 293.18572858 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.