CID 5277405

Ethyl n-(5-amino-2-methyl-3-phenyl-pyrido[3,4-b]pyrazin-7-yl)carbamate

Structural Information

Molecular Formula
C17H17N5O2
SMILES
CCOC(=O)NC1=NC(=C2C(=C1)N=C(C(=N2)C3=CC=CC=C3)C)N
InChI
InChI=1S/C17H17N5O2/c1-3-24-17(23)21-13-9-12-15(16(18)20-13)22-14(10(2)19-12)11-7-5-4-6-8-11/h4-9H,3H2,1-2H3,(H3,18,20,21,23)
InChIKey
RWGZINDXXMOTDZ-UHFFFAOYSA-N
Compound name
ethyl N-(5-amino-2-methyl-3-phenylpyrido[3,4-b]pyrazin-7-yl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

323.1382 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 324.145476 177.7
[M+Na]+ 346.127418 186.2
[M-H]- 322.130924 181.5
[M+NH4]+ 341.172023 188.1
[M+K]+ 362.101358 180.9
[M+H-H2O]+ 306.135460 167.0
[M+HCOO]- 368.136401 197.7
[M+CH3COO]- 382.152051 214.0
[M+Na-2H]- 344.112866 183.6
[M]+ 323.13765142 178.6
[M]- 323.13874858 178.6
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

No patent data available for this compound.