CID 165500886

Tert-butyl n-(4-{3h,4h,5h,6h,7h-imidazo[4,5-c]pyridin-2-yl}phenyl)carbamate

Structural Information

Molecular Formula
C17H22N4O2
SMILES
CC(C)(C)OC(=O)NC1=CC=C(C=C1)C2=NC3=C(N2)CNCC3
InChI
InChI=1S/C17H22N4O2/c1-17(2,3)23-16(22)19-12-6-4-11(5-7-12)15-20-13-8-9-18-10-14(13)21-15/h4-7,18H,8-10H2,1-3H3,(H,19,22)(H,20,21)
InChIKey
XJNFWLROWYPYKA-UHFFFAOYSA-N
Compound name
tert-butyl N-[4-(4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-2-yl)phenyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

314.1743 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 315.18158 174.9
[M+Na]+ 337.16352 184.4
[M+NH4]+ 332.20812 180.4
[M+K]+ 353.13746 181.6
[M-H]- 313.16702 175.5
[M+Na-2H]- 335.14897 179.0
[M]+ 314.17375 176.0
[M]- 314.17485 176.0
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.