CID 56770224

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

Structural Information

Molecular Formula
C10H16N4O2
SMILES
CN1C(=O)C=C(NC1=O)N2CCCC(C2)N
InChI
InChI=1S/C10H16N4O2/c1-13-9(15)5-8(12-10(13)16)14-4-2-3-7(11)6-14/h5,7H,2-4,6,11H2,1H3,(H,12,16)
InChIKey
XTXAQEOHHNTCFA-UHFFFAOYSA-N
Compound name
6-(3-aminopiperidin-1-yl)-3-methyl-1H-pyrimidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

224.12732 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.13460 151.7
[M+Na]+ 247.11654 160.0
[M-H]- 223.12004 152.8
[M+NH4]+ 242.16114 164.9
[M+K]+ 263.09048 155.5
[M+H-H2O]+ 207.12458 142.9
[M+HCOO]- 269.12552 168.6
[M+CH3COO]- 283.14117 188.6
[M+Na-2H]- 245.10199 154.7
[M]+ 224.12677 146.1
[M]- 224.12787 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

patents stripe