CID 11971047

1-(3-homopiperidinopropyl)-3-aminoindazole

Structural Information

Molecular Formula
C16H24N4
SMILES
C1CCCN(CC1)CCCN2C3=CC=CC=C3C(=N2)N
InChI
InChI=1S/C16H24N4/c17-16-14-8-3-4-9-15(14)20(18-16)13-7-12-19-10-5-1-2-6-11-19/h3-4,8-9H,1-2,5-7,10-13H2,(H2,17,18)
InChIKey
NPDWBOLPBMKUGP-UHFFFAOYSA-N
Compound name
1-[3-(azepan-1-yl)propyl]indazol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

272.2001 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.207376 164.7
[M+Na]+ 295.189318 169.9
[M-H]- 271.192824 168.5
[M+NH4]+ 290.233923 178.2
[M+K]+ 311.163258 168.4
[M+H-H2O]+ 255.197360 154.1
[M+HCOO]- 317.198301 182.1
[M+CH3COO]- 331.213951 174.2
[M+Na-2H]- 293.174766 167.6
[M]+ 272.19955142 159.0
[M]- 272.20064858 159.0
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