CID 45051275

N-cyclopentyl-2-(4-ethylphenyl)-4-quinolinamine

Structural Information

Molecular Formula
C22H24N2
SMILES
CCC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)NC4CCCC4
InChI
InChI=1S/C22H24N2/c1-2-16-11-13-17(14-12-16)21-15-22(23-18-7-3-4-8-18)19-9-5-6-10-20(19)24-21/h5-6,9-15,18H,2-4,7-8H2,1H3,(H,23,24)
InChIKey
FPSULLRXPSAOSP-UHFFFAOYSA-N
Compound name
N-cyclopentyl-2-(4-ethylphenyl)quinolin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

316.19394 Da
Monoisotopic Mass

5.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 317.20122 176.6
[M+Na]+ 339.18316 182.2
[M-H]- 315.18666 185.1
[M+NH4]+ 334.22776 191.7
[M+K]+ 355.15710 175.2
[M+H-H2O]+ 299.19120 166.6
[M+HCOO]- 361.19214 196.9
[M+CH3COO]- 375.20779 186.8
[M+Na-2H]- 337.16861 179.2
[M]+ 316.19339 173.3
[M]- 316.19449 173.3
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.