CID 3021373

1-(3-piperidinobutyl)-3-aminoindazole

Structural Information

Molecular Formula
C16H24N4
SMILES
CC(CCN1C2=CC=CC=C2C(=N1)N)N3CCCCC3
InChI
InChI=1S/C16H24N4/c1-13(19-10-5-2-6-11-19)9-12-20-15-8-4-3-7-14(15)16(17)18-20/h3-4,7-8,13H,2,5-6,9-12H2,1H3,(H2,17,18)
InChIKey
HBRMYSQKTBVBHF-UHFFFAOYSA-N
Compound name
1-(3-piperidin-1-ylbutyl)indazol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

272.2001 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.20738 166.1
[M+Na]+ 295.18932 171.8
[M-H]- 271.19282 168.5
[M+NH4]+ 290.23392 180.4
[M+K]+ 311.16326 166.8
[M+H-H2O]+ 255.19736 156.0
[M+HCOO]- 317.19830 182.9
[M+CH3COO]- 331.21395 175.7
[M+Na-2H]- 293.17477 168.2
[M]+ 272.19955 162.6
[M]- 272.20065 162.6
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