CID 54902861

N-(piperidin-4-yl)quinolin-5-amine

Structural Information

Molecular Formula
C14H17N3
SMILES
C1CNCCC1NC2=CC=CC3=C2C=CC=N3
InChI
InChI=1S/C14H17N3/c1-4-13-12(3-2-8-16-13)14(5-1)17-11-6-9-15-10-7-11/h1-5,8,11,15,17H,6-7,9-10H2
InChIKey
IOXKHPMEVPDLGE-UHFFFAOYSA-N
Compound name
N-piperidin-4-ylquinolin-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

227.14224 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 228.149516 150.5
[M+Na]+ 250.131458 155.2
[M-H]- 226.134964 152.7
[M+NH4]+ 245.176063 165.2
[M+K]+ 266.105398 149.6
[M+H-H2O]+ 210.139500 141.2
[M+HCOO]- 272.140441 167.3
[M+CH3COO]- 286.156091 160.4
[M+Na-2H]- 248.116906 158.3
[M]+ 227.14169142 142.9
[M]- 227.14278858 142.9
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.