CID 6481448

N-(2-aminoethyl)-1-methyl-9h-pyrido[3,4-b]indole-3-carboxamide

Structural Information

Molecular Formula
C15H16N4O
SMILES
CC1=C2C(=CC(=N1)C(=O)NCCN)C3=CC=CC=C3N2
InChI
InChI=1S/C15H16N4O/c1-9-14-11(10-4-2-3-5-12(10)19-14)8-13(18-9)15(20)17-7-6-16/h2-5,8,19H,6-7,16H2,1H3,(H,17,20)
InChIKey
OJBJUEPBDRVECB-UHFFFAOYSA-N
Compound name
N-(2-aminoethyl)-1-methyl-9H-pyrido[3,4-b]indole-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

268.13242 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.13970 160.2
[M+Na]+ 291.12164 169.4
[M-H]- 267.12514 162.1
[M+NH4]+ 286.16624 176.9
[M+K]+ 307.09558 163.5
[M+H-H2O]+ 251.12968 152.5
[M+HCOO]- 313.13062 181.5
[M+CH3COO]- 327.14627 171.5
[M+Na-2H]- 289.10709 166.3
[M]+ 268.13187 160.2
[M]- 268.13297 160.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.