CID 80336730

N-methyl-6-(piperazin-1-yl)pyridazine-3-carboxamide dihydrochloride

Structural Information

Molecular Formula
C10H15N5O
SMILES
CNC(=O)C1=NN=C(C=C1)N2CCNCC2
InChI
InChI=1S/C10H15N5O/c1-11-10(16)8-2-3-9(14-13-8)15-6-4-12-5-7-15/h2-3,12H,4-7H2,1H3,(H,11,16)
InChIKey
CXVSKYJNJIIXFI-UHFFFAOYSA-N
Compound name
N-methyl-6-piperazin-1-ylpyridazine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

221.12766 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 222.13494 152.0
[M+Na]+ 244.11688 157.1
[M-H]- 220.12038 151.2
[M+NH4]+ 239.16148 163.3
[M+K]+ 260.09082 153.3
[M+H-H2O]+ 204.12492 141.9
[M+HCOO]- 266.12586 167.0
[M+CH3COO]- 280.14151 187.2
[M+Na-2H]- 242.10233 157.4
[M]+ 221.12711 145.3
[M]- 221.12821 145.3
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.