CID 3068042

3-(2-piperidinoethylamino)indazole

Structural Information

Molecular Formula
C14H20N4
SMILES
C1CCN(CC1)CCNC2=NNC3=CC=CC=C32
InChI
InChI=1S/C14H20N4/c1-4-9-18(10-5-1)11-8-15-14-12-6-2-3-7-13(12)16-17-14/h2-3,6-7H,1,4-5,8-11H2,(H2,15,16,17)
InChIKey
MQMXKSFEOSAPQP-UHFFFAOYSA-N
Compound name
N-(2-piperidin-1-ylethyl)-1H-indazol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

244.1688 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.17608 155.1
[M+Na]+ 267.15802 160.6
[M-H]- 243.16152 156.4
[M+NH4]+ 262.20262 169.8
[M+K]+ 283.13196 155.1
[M+H-H2O]+ 227.16606 145.2
[M+HCOO]- 289.16700 172.8
[M+CH3COO]- 303.18265 165.0
[M+Na-2H]- 265.14347 160.9
[M]+ 244.16825 150.3
[M]- 244.16935 150.3
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