CID 65956722

3-[(5-aminopyridin-2-yl)amino]piperidine-2,6-dione

Structural Information

Molecular Formula

C₁₀H₁₂N₄O₂

SMILES

C1CC(=O)NC(=O)C1NC2=NC=C(C=C2)N

InChI

InChI=1S/C10H12N4O2/c11-6-1-3-8(12-5-6)13-7-2-4-9(15)14-10(7)16/h1,3,5,7H,2,4,11H2,(H,12,13)(H,14,15,16)

InChIKey

IVOCZJIIDUSKRQ-UHFFFAOYSA-N

Compound name

3-[(5-amino-2-pyridinyl)amino]piperidine-2,6-dione

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 220.09602 Da
Monoisotopic Mass: -0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	221.103296	148.1
[M+Na]+	243.085238	154.6
[M-H]-	219.088744	150.3
[M+NH4]+	238.129843	162.0
[M+K]+	259.059178	150.4
[M+H-H2O]+	203.093280	139.6
[M+HCOO]-	265.094221	167.6
[M+CH3COO]-	279.109871	189.5
[M+Na-2H]-	241.070686	152.6
[M]+	220.09547142	141.0
[M]-	220.09656858	141.0

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.