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]+ 210.134936 147.1
[M+Na]+ 232.116878 152.4
[M-H]- 208.120384 147.4
[M+NH4]+ 227.161483 161.5
[M+K]+ 248.090818 148.9
[M+H-H2O]+ 192.124920 138.2
[M+HCOO]- 254.125861 164.4
[M+CH3COO]- 268.141511 187.0
[M+Na-2H]- 230.102326 148.1
[M]+ 209.12711142 138.2
[M]- 209.12820858 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.