CID 18524625

N-(5-aminopyridin-2-yl)cyclopropanecarboxamide

Structural Information

Molecular Formula

C₉H₁₁N₃O

SMILES

C1CC1C(=O)NC2=NC=C(C=C2)N

InChI

InChI=1S/C9H11N3O/c10-7-3-4-8(11-5-7)12-9(13)6-1-2-6/h3-6H,1-2,10H2,(H,11,12,13)

InChIKey

BVMZQTANRUNAPN-UHFFFAOYSA-N

Compound name

N-(5-amino-2-pyridinyl)cyclopropanecarboxamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 177.09021 Da
Monoisotopic Mass: 0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	178.097486	136.8
[M+Na]+	200.079428	145.6
[M-H]-	176.082934	142.9
[M+NH4]+	195.124033	150.0
[M+K]+	216.053368	141.9
[M+H-H2O]+	160.087470	129.4
[M+HCOO]-	222.088411	161.6
[M+CH3COO]-	236.104061	187.2
[M+Na-2H]-	198.064876	143.3
[M]+	177.08966142	136.5
[M]-	177.09075858	136.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe