CID 56770223

6-(4-aminopiperidin-1-yl)-3-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione dihydrochloride

Structural Information

Molecular Formula
C10H16N4O2
SMILES
CN1C(=O)C=C(NC1=O)N2CCC(CC2)N
InChI
InChI=1S/C10H16N4O2/c1-13-9(15)6-8(12-10(13)16)14-4-2-7(11)3-5-14/h6-7H,2-5,11H2,1H3,(H,12,16)
InChIKey
CWUYXYZIJQKRCF-UHFFFAOYSA-N
Compound name
6-(4-aminopiperidin-1-yl)-3-methyl-1H-pyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

224.12732 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.134596 151.7
[M+Na]+ 247.116538 160.0
[M-H]- 223.120044 152.8
[M+NH4]+ 242.161143 164.9
[M+K]+ 263.090478 155.5
[M+H-H2O]+ 207.124580 142.9
[M+HCOO]- 269.125521 168.6
[M+CH3COO]- 283.141171 188.6
[M+Na-2H]- 245.101986 154.7
[M]+ 224.12677142 146.1
[M]- 224.12786858 146.1
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.