CID 3055432

72418-37-2

Structural Information

Molecular Formula
C15H25N5O2
SMILES
CCN1CCCC1CNC(=O)C2=CN=C(N=C2OC)N(C)C
InChI
InChI=1S/C15H25N5O2/c1-5-20-8-6-7-11(20)9-16-13(21)12-10-17-15(19(2)3)18-14(12)22-4/h10-11H,5-9H2,1-4H3,(H,16,21)
InChIKey
PQBAJPIJGUWMTD-UHFFFAOYSA-N
Compound name
2-(dimethylamino)-N-[(1-ethylpyrrolidin-2-yl)methyl]-4-methoxypyrimidine-5-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

307.20084 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 308.20812 174.4
[M+Na]+ 330.19006 179.4
[M-H]- 306.19356 178.3
[M+NH4]+ 325.23466 187.1
[M+K]+ 346.16400 177.8
[M+H-H2O]+ 290.19810 164.1
[M+HCOO]- 352.19904 194.6
[M+CH3COO]- 366.21469 214.0
[M+Na-2H]- 328.17551 174.6
[M]+ 307.20029 175.8
[M]- 307.20139 175.8
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.