CID 453064

Quinoline, 2-(3-pyridinyl)-4-(1-pyrrolidinyl)-

Structural Information

Molecular Formula
C18H17N3
SMILES
C1CCN(C1)C2=CC(=NC3=CC=CC=C32)C4=CN=CC=C4
InChI
InChI=1S/C18H17N3/c1-2-8-16-15(7-1)18(21-10-3-4-11-21)12-17(20-16)14-6-5-9-19-13-14/h1-2,5-9,12-13H,3-4,10-11H2
InChIKey
QIIXIROOWAWACN-UHFFFAOYSA-N
Compound name
2-pyridin-3-yl-4-pyrrolidin-1-ylquinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

275.14224 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.14952 164.8
[M+Na]+ 298.13146 172.1
[M-H]- 274.13496 170.8
[M+NH4]+ 293.17606 178.8
[M+K]+ 314.10540 165.6
[M+H-H2O]+ 258.13950 153.6
[M+HCOO]- 320.14044 182.7
[M+CH3COO]- 334.15609 175.3
[M+Na-2H]- 296.11691 169.3
[M]+ 275.14169 161.4
[M]- 275.14279 161.4
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

No patent data available for this compound.