CID 43114377

N-(5-chloropyridin-2-yl)piperidine-3-carboxamide

Structural Information

Molecular Formula

C₁₁H₁₄ClN₃O

SMILES

C1CC(CNC1)C(=O)NC2=NC=C(C=C2)Cl

InChI

InChI=1S/C11H14ClN3O/c12-9-3-4-10(14-7-9)15-11(16)8-2-1-5-13-6-8/h3-4,7-8,13H,1-2,5-6H2,(H,14,15,16)

InChIKey

UVDVBUWYEJTZRA-UHFFFAOYSA-N

Compound name

N-(5-chloro-2-pyridinyl)piperidine-3-carboxamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 239.08253 Da
Monoisotopic Mass: 1.0
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]+	240.089806	152.4
[M+Na]+	262.071748	157.6
[M-H]-	238.075254	153.9
[M+NH4]+	257.116353	166.6
[M+K]+	278.045688	152.4
[M+H-H2O]+	222.079790	144.3
[M+HCOO]-	284.080731	165.1
[M+CH3COO]-	298.096381	188.0
[M+Na-2H]-	260.057196	156.7
[M]+	239.08198142	147.0
[M]-	239.08307858	147.0

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.