CID 21906241

2-amino-n-(5-chloropyridin-2-yl)-5-methoxybenzamide

Structural Information

Molecular Formula
C13H12ClN3O2
SMILES
COC1=CC(=C(C=C1)N)C(=O)NC2=NC=C(C=C2)Cl
InChI
InChI=1S/C13H12ClN3O2/c1-19-9-3-4-11(15)10(6-9)13(18)17-12-5-2-8(14)7-16-12/h2-7H,15H2,1H3,(H,16,17,18)
InChIKey
GCCIHZVIPXGAPR-UHFFFAOYSA-N
Compound name
2-amino-N-(5-chloropyridin-2-yl)-5-methoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

102
Patents

277.0618 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.06908 160.5
[M+Na]+ 300.05102 174.3
[M+NH4]+ 295.09562 168.0
[M+K]+ 316.02496 167.4
[M-H]- 276.05452 164.8
[M+Na-2H]- 298.03647 168.8
[M]+ 277.06125 163.8
[M]- 277.06235 163.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

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Patent stripe

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