CID 99795472

5-amino-1-(piperidin-4-yl)-1h-imidazole-4-carboxamide

Structural Information

Molecular Formula
C9H15N5O
SMILES
C1CNCCC1N2C=NC(=C2N)C(=O)N
InChI
InChI=1S/C9H15N5O/c10-8-7(9(11)15)13-5-14(8)6-1-3-12-4-2-6/h5-6,12H,1-4,10H2,(H2,11,15)
InChIKey
OZBQPIMGEQMBGJ-UHFFFAOYSA-N
Compound name
5-amino-1-piperidin-4-ylimidazole-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

209.12766 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 210.13494 147.1
[M+Na]+ 232.11688 152.4
[M-H]- 208.12038 147.4
[M+NH4]+ 227.16148 161.5
[M+K]+ 248.09082 148.9
[M+H-H2O]+ 192.12492 138.2
[M+HCOO]- 254.12586 164.4
[M+CH3COO]- 268.14151 187.0
[M+Na-2H]- 230.10233 148.1
[M]+ 209.12711 138.2
[M]- 209.12821 138.2
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

No patent data available for this compound.