CID 3065651

3-(3-morpholinopropylamino)indazole

Structural Information

Molecular Formula
C14H20N4O
SMILES
C1COCCN1CCCNC2=NNC3=CC=CC=C32
InChI
InChI=1S/C14H20N4O/c1-2-5-13-12(4-1)14(17-16-13)15-6-3-7-18-8-10-19-11-9-18/h1-2,4-5H,3,6-11H2,(H2,15,16,17)
InChIKey
NIYFKJYEUPPINB-UHFFFAOYSA-N
Compound name
N-(3-morpholin-4-ylpropyl)-1H-indazol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

260.1637 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.170976 158.5
[M+Na]+ 283.152918 164.1
[M-H]- 259.156424 160.5
[M+NH4]+ 278.197523 171.2
[M+K]+ 299.126858 160.0
[M+H-H2O]+ 243.160960 148.6
[M+HCOO]- 305.161901 175.4
[M+CH3COO]- 319.177551 168.3
[M+Na-2H]- 281.138366 164.7
[M]+ 260.16315142 155.7
[M]- 260.16424858 155.7
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