CID 43251299

3-[4-(pyridin-4-yl)piperazin-1-yl]propan-1-amine

Structural Information

Molecular Formula
C12H20N4
SMILES
C1CN(CCN1CCCN)C2=CC=NC=C2
InChI
InChI=1S/C12H20N4/c13-4-1-7-15-8-10-16(11-9-15)12-2-5-14-6-3-12/h2-3,5-6H,1,4,7-11,13H2
InChIKey
SPDPAWCDGSUUKN-UHFFFAOYSA-N
Compound name
3-(4-pyridin-4-ylpiperazin-1-yl)propan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

220.1688 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.17608 153.0
[M+Na]+ 243.15802 164.7
[M+NH4]+ 238.20262 160.6
[M+K]+ 259.13196 157.6
[M-H]- 219.16152 156.1
[M+Na-2H]- 241.14347 160.1
[M]+ 220.16825 155.3
[M]- 220.16935 155.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe