CID 54690366

4-hydroxy-1-methyl-n-[3-(methylamino)propyl]-2-oxo-quinoline-3-carboxamide

Structural Information

Molecular Formula
C15H19N3O3
SMILES
CNCCCNC(=O)C1=C(C2=CC=CC=C2N(C1=O)C)O
InChI
InChI=1S/C15H19N3O3/c1-16-8-5-9-17-14(20)12-13(19)10-6-3-4-7-11(10)18(2)15(12)21/h3-4,6-7,16,19H,5,8-9H2,1-2H3,(H,17,20)
InChIKey
BRKODZAWTGYDES-UHFFFAOYSA-N
Compound name
4-hydroxy-1-methyl-N-[3-(methylamino)propyl]-2-oxoquinoline-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

289.14264 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 290.14992 165.9
[M+Na]+ 312.13186 173.6
[M-H]- 288.13536 168.2
[M+NH4]+ 307.17646 180.5
[M+K]+ 328.10580 169.7
[M+H-H2O]+ 272.13990 158.1
[M+HCOO]- 334.14084 187.4
[M+CH3COO]- 348.15649 206.9
[M+Na-2H]- 310.11731 170.6
[M]+ 289.14209 167.7
[M]- 289.14319 167.7
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.