CID 43461944

866620-36-2

Structural Information

Molecular Formula
C12H20N4
SMILES
CC(C)N1CCN(CC1)C2=CN=C(C=C2)N
InChI
InChI=1S/C12H20N4/c1-10(2)15-5-7-16(8-6-15)11-3-4-12(13)14-9-11/h3-4,9-10H,5-8H2,1-2H3,(H2,13,14)
InChIKey
GAPKLZRRWLERHL-UHFFFAOYSA-N
Compound name
5-(4-propan-2-ylpiperazin-1-yl)pyridin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

293
Patents

220.1688 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.176076 154.3
[M+Na]+ 243.158018 159.6
[M-H]- 219.161524 155.7
[M+NH4]+ 238.202623 167.9
[M+K]+ 259.131958 156.2
[M+H-H2O]+ 203.166060 144.7
[M+HCOO]- 265.167001 170.4
[M+CH3COO]- 279.182651 192.5
[M+Na-2H]- 241.143466 157.3
[M]+ 220.16825142 148.4
[M]- 220.16934858 148.4
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