CID 3079849

1,8-naphthyridine-3-carboxamide, 4-chloro-2-(cyclopropylamino)-n,n-diethyl-

Structural Information

Molecular Formula
C16H19ClN4O
SMILES
CCN(CC)C(=O)C1=C(N=C2C(=C1Cl)C=CC=N2)NC3CC3
InChI
InChI=1S/C16H19ClN4O/c1-3-21(4-2)16(22)12-13(17)11-6-5-9-18-14(11)20-15(12)19-10-7-8-10/h5-6,9-10H,3-4,7-8H2,1-2H3,(H,18,19,20)
InChIKey
CFWSDONFYIQTGJ-UHFFFAOYSA-N
Compound name
4-chloro-2-(cyclopropylamino)-N,N-diethyl-1,8-naphthyridine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

318.12473 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 319.13201 176.1
[M+Na]+ 341.11395 185.4
[M-H]- 317.11745 182.4
[M+NH4]+ 336.15855 185.3
[M+K]+ 357.08789 179.2
[M+H-H2O]+ 301.12199 167.4
[M+HCOO]- 363.12293 193.5
[M+CH3COO]- 377.13858 217.1
[M+Na-2H]- 339.09940 180.2
[M]+ 318.12418 182.1
[M]- 318.12528 182.1
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.