CID 16790972

6-(cyclopentyloxy)pyridin-3-amine

Structural Information

Molecular Formula

C₁₀H₁₄N₂O

SMILES

C1CCC(C1)OC2=NC=C(C=C2)N

InChI

InChI=1S/C10H14N2O/c11-8-5-6-10(12-7-8)13-9-3-1-2-4-9/h5-7,9H,1-4,11H2

InChIKey

WMSWCWLWVISCKC-UHFFFAOYSA-N

Compound name

6-cyclopentyloxypyridin-3-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 91
Patents: 178.11061 Da
Monoisotopic Mass: 1.7
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]+	179.117886	137.6
[M+Na]+	201.099828	143.8
[M-H]-	177.103334	142.2
[M+NH4]+	196.144433	157.3
[M+K]+	217.073768	141.5
[M+H-H2O]+	161.107870	130.1
[M+HCOO]-	223.108811	160.6
[M+CH3COO]-	237.124461	180.5
[M+Na-2H]-	199.085276	142.0
[M]+	178.11006142	133.8
[M]-	178.11115858	133.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe