CID 22393771

N-(piperidin-4-yl)pyridin-3-amine

Structural Information

Molecular Formula

C₁₀H₁₅N₃

SMILES

C1CNCCC1NC2=CN=CC=C2

InChI

InChI=1S/C10H15N3/c1-2-10(8-12-5-1)13-9-3-6-11-7-4-9/h1-2,5,8-9,11,13H,3-4,6-7H2

InChIKey

UUXXGTMOTIUHPW-UHFFFAOYSA-N

Compound name

N-piperidin-4-ylpyridin-3-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 53
Patents: 177.1266 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]+	178.133876	139.0
[M+Na]+	200.115818	142.9
[M-H]-	176.119324	140.3
[M+NH4]+	195.160423	154.6
[M+K]+	216.089758	139.2
[M+H-H2O]+	160.123860	130.3
[M+HCOO]-	222.124801	157.2
[M+CH3COO]-	236.140451	149.5
[M+Na-2H]-	198.101266	146.3
[M]+	177.12605142	130.8
[M]-	177.12714858	130.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe