CID 71240907

4-(piperazin-1-yl)pyridine-3-carboxamide dihydrochloride

Structural Information

Molecular Formula
C10H14N4O
SMILES
C1CN(CCN1)C2=C(C=NC=C2)C(=O)N
InChI
InChI=1S/C10H14N4O/c11-10(15)8-7-13-2-1-9(8)14-5-3-12-4-6-14/h1-2,7,12H,3-6H2,(H2,11,15)
InChIKey
TXHMBSDELPJEET-UHFFFAOYSA-N
Compound name
4-piperazin-1-ylpyridine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

206.11676 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.12404 147.2
[M+Na]+ 229.10598 152.2
[M-H]- 205.10948 147.3
[M+NH4]+ 224.15058 160.2
[M+K]+ 245.07992 148.3
[M+H-H2O]+ 189.11402 138.0
[M+HCOO]- 251.11496 162.9
[M+CH3COO]- 265.13061 184.2
[M+Na-2H]- 227.09143 151.6
[M]+ 206.11621 139.1
[M]- 206.11731 139.1
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