CID 199808

2-(4-methylpiperazin-1-yl)pyridin-3-amine

Structural Information

Molecular Formula
C10H16N4
SMILES
CN1CCN(CC1)C2=C(C=CC=N2)N
InChI
InChI=1S/C10H16N4/c1-13-5-7-14(8-6-13)10-9(11)3-2-4-12-10/h2-4H,5-8,11H2,1H3
InChIKey
IFHQJBQZOLOOHW-UHFFFAOYSA-N
Compound name
2-(4-methylpiperazin-1-yl)pyridin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

54
Patents

192.1375 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.144776 145.4
[M+Na]+ 215.126718 151.8
[M-H]- 191.130224 147.0
[M+NH4]+ 210.171323 160.2
[M+K]+ 231.100658 148.4
[M+H-H2O]+ 175.134760 136.0
[M+HCOO]- 237.135701 163.2
[M+CH3COO]- 251.151351 156.3
[M+Na-2H]- 213.112166 150.5
[M]+ 192.13695142 139.4
[M]- 192.13804858 139.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe