CID 3021346

3-(3-piperidinobutylamino)indazole

Structural Information

Molecular Formula
C16H24N4
SMILES
CC(CCNC1=NNC2=CC=CC=C21)N3CCCCC3
InChI
InChI=1S/C16H24N4/c1-13(20-11-5-2-6-12-20)9-10-17-16-14-7-3-4-8-15(14)18-19-16/h3-4,7-8,13H,2,5-6,9-12H2,1H3,(H2,17,18,19)
InChIKey
WGMNJXFDKMUVJT-UHFFFAOYSA-N
Compound name
N-(3-piperidin-1-ylbutyl)-1H-indazol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

272.2001 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.20738 164.6
[M+Na]+ 295.18932 168.9
[M-H]- 271.19282 165.8
[M+NH4]+ 290.23392 178.1
[M+K]+ 311.16326 163.4
[M+H-H2O]+ 255.19736 154.6
[M+HCOO]- 317.19830 180.6
[M+CH3COO]- 331.21395 173.5
[M+Na-2H]- 293.17477 168.2
[M]+ 272.19955 159.9
[M]- 272.20065 159.9
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