CID 54592598

1-(pyrimidin-4-yl)piperidin-3-amine dihydrochloride

Structural Information

Molecular Formula

C₉H₁₄N₄

SMILES

C1CC(CN(C1)C2=NC=NC=C2)N

InChI

InChI=1S/C9H14N4/c10-8-2-1-5-13(6-8)9-3-4-11-7-12-9/h3-4,7-8H,1-2,5-6,10H2

InChIKey

AYHGBQRVBWIMAJ-UHFFFAOYSA-N

Compound name

1-pyrimidin-4-ylpiperidin-3-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 178.12184 Da
Monoisotopic Mass: 0.3
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]+	179.12912	139.7
[M+Na]+	201.11106	152.0
[M+NH4]+	196.15566	147.8
[M+K]+	217.08500	145.6
[M-H]-	177.11456	142.9
[M+Na-2H]-	199.09651	147.6
[M]+	178.12129	142.1
[M]-	178.12239	142.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe