CID 3055408

Brn 0813629

Structural Information

Molecular Formula
C14H23N5O2
SMILES
CCN1CCCC1CNC(=O)C2=CN=C(N=C2OC)NC
InChI
InChI=1S/C14H23N5O2/c1-4-19-7-5-6-10(19)8-16-12(20)11-9-17-14(15-2)18-13(11)21-3/h9-10H,4-8H2,1-3H3,(H,16,20)(H,15,17,18)
InChIKey
FBFPGCHGRRYSGL-UHFFFAOYSA-N
Compound name
N-[(1-ethylpyrrolidin-2-yl)methyl]-4-methoxy-2-(methylamino)pyrimidine-5-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

293.18518 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 294.19246 170.1
[M+Na]+ 316.17440 178.7
[M+NH4]+ 311.21900 175.1
[M+K]+ 332.14834 175.8
[M-H]- 292.17790 171.5
[M+Na-2H]- 314.15985 174.1
[M]+ 293.18463 171.2
[M]- 293.18573 171.2
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