CID 103962701

4-(4-ethylpiperazin-1-yl)quinolin-3-amine

Structural Information

Molecular Formula
C15H20N4
SMILES
CCN1CCN(CC1)C2=C(C=NC3=CC=CC=C32)N
InChI
InChI=1S/C15H20N4/c1-2-18-7-9-19(10-8-18)15-12-5-3-4-6-14(12)17-11-13(15)16/h3-6,11H,2,7-10,16H2,1H3
InChIKey
WMCZQGKIXMGQFS-UHFFFAOYSA-N
Compound name
4-(4-ethylpiperazin-1-yl)quinolin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

256.1688 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.176076 162.8
[M+Na]+ 279.158018 169.3
[M-H]- 255.161524 165.0
[M+NH4]+ 274.202623 176.0
[M+K]+ 295.131958 163.8
[M+H-H2O]+ 239.166060 152.4
[M+HCOO]- 301.167001 178.6
[M+CH3COO]- 315.182651 172.4
[M+Na-2H]- 277.143466 167.7
[M]+ 256.16825142 157.6
[M]- 256.16934858 157.6
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

No patent data available for this compound.