CID 453065

4-(piperidin-1-yl)-2-(pyridin-3-yl)quinoline

Structural Information

Molecular Formula
C19H19N3
SMILES
C1CCN(CC1)C2=CC(=NC3=CC=CC=C32)C4=CN=CC=C4
InChI
InChI=1S/C19H19N3/c1-4-11-22(12-5-1)19-13-18(15-7-6-10-20-14-15)21-17-9-3-2-8-16(17)19/h2-3,6-10,13-14H,1,4-5,11-12H2
InChIKey
AXUYHABNGUKJLE-UHFFFAOYSA-N
Compound name
4-piperidin-1-yl-2-pyridin-3-ylquinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

289.1579 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 290.16518 170.2
[M+Na]+ 312.14712 176.0
[M-H]- 288.15062 175.2
[M+NH4]+ 307.19172 181.4
[M+K]+ 328.12106 169.0
[M+H-H2O]+ 272.15516 157.8
[M+HCOO]- 334.15610 185.2
[M+CH3COO]- 348.17175 179.2
[M+Na-2H]- 310.13257 176.3
[M]+ 289.15735 164.5
[M]- 289.15845 164.5
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

No patent data available for this compound.