CID 506606

Nicotinic acid pyrimidin-2-ylamide

Structural Information

Molecular Formula
C10H8N4O
SMILES
C1=CC(=CN=C1)C(=O)NC2=NC=CC=N2
InChI
InChI=1S/C10H8N4O/c15-9(8-3-1-4-11-7-8)14-10-12-5-2-6-13-10/h1-7H,(H,12,13,14,15)
InChIKey
CFRIBDQMHYGXLL-UHFFFAOYSA-N
Compound name
N-pyrimidin-2-ylpyridine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

200.06981 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.07709 141.5
[M+Na]+ 223.05903 149.1
[M-H]- 199.06253 144.2
[M+NH4]+ 218.10363 155.6
[M+K]+ 239.03297 145.7
[M+H-H2O]+ 183.06707 131.8
[M+HCOO]- 245.06801 163.7
[M+CH3COO]- 259.08366 153.5
[M+Na-2H]- 221.04448 151.4
[M]+ 200.06926 140.0
[M]- 200.07036 140.0
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.