CID 39732565

N-(2-aminoethyl)-1-methyl-1h-indole-2-carboxamide

Structural Information

Molecular Formula
C12H15N3O
SMILES
CN1C2=CC=CC=C2C=C1C(=O)NCCN
InChI
InChI=1S/C12H15N3O/c1-15-10-5-3-2-4-9(10)8-11(15)12(16)14-7-6-13/h2-5,8H,6-7,13H2,1H3,(H,14,16)
InChIKey
BVGKGZCOQLCCFE-UHFFFAOYSA-N
Compound name
N-(2-aminoethyl)-1-methylindole-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

217.1215 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 218.12878 147.9
[M+Na]+ 240.11072 159.0
[M+NH4]+ 235.15532 155.7
[M+K]+ 256.08466 154.7
[M-H]- 216.11422 150.2
[M+Na-2H]- 238.09617 153.4
[M]+ 217.12095 149.9
[M]- 217.12205 149.9
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