CID 62154156

2-(4-methylpiperazine-1-carbonyl)pyridin-4-amine

Structural Information

Molecular Formula
C11H16N4O
SMILES
CN1CCN(CC1)C(=O)C2=NC=CC(=C2)N
InChI
InChI=1S/C11H16N4O/c1-14-4-6-15(7-5-14)11(16)10-8-9(12)2-3-13-10/h2-3,8H,4-7H2,1H3,(H2,12,13)
InChIKey
QDELEMUAOBPFMP-UHFFFAOYSA-N
Compound name
(4-aminopyridin-2-yl)-(4-methylpiperazin-1-yl)methanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

220.13242 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.13970 150.9
[M+Na]+ 243.12164 162.3
[M+NH4]+ 238.16624 157.6
[M+K]+ 259.09558 157.0
[M-H]- 219.12514 153.1
[M+Na-2H]- 241.10709 157.1
[M]+ 220.13187 152.8
[M]- 220.13297 152.8
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