CID 459648

N,n-dipropylquinoline-3-carboxamide

Structural Information

Molecular Formula
C16H20N2O
SMILES
CCCN(CCC)C(=O)C1=CC2=CC=CC=C2N=C1
InChI
InChI=1S/C16H20N2O/c1-3-9-18(10-4-2)16(19)14-11-13-7-5-6-8-15(13)17-12-14/h5-8,11-12H,3-4,9-10H2,1-2H3
InChIKey
GOAQPCBWTXBEHE-UHFFFAOYSA-N
Compound name
N,N-dipropylquinoline-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

256.15756 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.16484 161.4
[M+Na]+ 279.14678 167.4
[M-H]- 255.15028 165.2
[M+NH4]+ 274.19138 178.3
[M+K]+ 295.12072 164.5
[M+H-H2O]+ 239.15482 153.0
[M+HCOO]- 301.15576 183.1
[M+CH3COO]- 315.17141 203.2
[M+Na-2H]- 277.13223 166.8
[M]+ 256.15701 163.9
[M]- 256.15811 163.9
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

patents stripe