CID 485002

N-phenethyl-1,6-naphthyridine-2-carboxamide

Structural Information

Molecular Formula
C17H15N3O
SMILES
C1=CC=C(C=C1)CCNC(=O)C2=NC3=C(C=C2)C=NC=C3
InChI
InChI=1S/C17H15N3O/c21-17(19-11-8-13-4-2-1-3-5-13)16-7-6-14-12-18-10-9-15(14)20-16/h1-7,9-10,12H,8,11H2,(H,19,21)
InChIKey
PQSMVQIVPPFZGT-UHFFFAOYSA-N
Compound name
N-(2-phenylethyl)-1,6-naphthyridine-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

4
Patents

277.12152 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.12880 163.6
[M+Na]+ 300.11074 170.3
[M-H]- 276.11424 167.9
[M+NH4]+ 295.15534 177.0
[M+K]+ 316.08468 164.8
[M+H-H2O]+ 260.11878 153.4
[M+HCOO]- 322.11972 184.4
[M+CH3COO]- 336.13537 174.2
[M+Na-2H]- 298.09619 172.1
[M]+ 277.12097 163.0
[M]- 277.12207 163.0
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.