CID 10013750

147539-21-7

Structural Information

Molecular Formula
C12H20N4
SMILES
CC(C)NC1=C(N=CC=C1)N2CCNCC2
InChI
InChI=1S/C12H20N4/c1-10(2)15-11-4-3-5-14-12(11)16-8-6-13-7-9-16/h3-5,10,13,15H,6-9H2,1-2H3
InChIKey
COALJHRGWIXLFP-UHFFFAOYSA-N
Compound name
2-piperazin-1-yl-N-propan-2-ylpyridin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

58
Patents

220.1688 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.176076 153.6
[M+Na]+ 243.158018 157.5
[M-H]- 219.161524 153.7
[M+NH4]+ 238.202623 166.4
[M+K]+ 259.131958 153.5
[M+H-H2O]+ 203.166060 144.0
[M+HCOO]- 265.167001 168.9
[M+CH3COO]- 279.182651 189.5
[M+Na-2H]- 241.143466 158.0
[M]+ 220.16825142 146.5
[M]- 220.16934858 146.5
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