CID 856136

N-(4-amino-2-methoxyphenyl)nicotinamide

Structural Information

Molecular Formula
C13H13N3O2
SMILES
COC1=C(C=CC(=C1)N)NC(=O)C2=CN=CC=C2
InChI
InChI=1S/C13H13N3O2/c1-18-12-7-10(14)4-5-11(12)16-13(17)9-3-2-6-15-8-9/h2-8H,14H2,1H3,(H,16,17)
InChIKey
FYMHBXHJILVCKD-UHFFFAOYSA-N
Compound name
N-(4-amino-2-methoxyphenyl)pyridine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

243.10077 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 244.10805 154.5
[M+Na]+ 266.08999 167.1
[M+NH4]+ 261.13459 161.7
[M+K]+ 282.06393 161.0
[M-H]- 242.09349 158.8
[M+Na-2H]- 264.07544 163.1
[M]+ 243.10022 157.3
[M]- 243.10132 157.3
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