CID 14477738

4-(4-(4-amino-3-methoxyphenyl)piperazin-1-yl)-2-methoxyaniline

Structural Information

Molecular Formula
C18H24N4O2
SMILES
COC1=C(C=CC(=C1)N2CCN(CC2)C3=CC(=C(C=C3)N)OC)N
InChI
InChI=1S/C18H24N4O2/c1-23-17-11-13(3-5-15(17)19)21-7-9-22(10-8-21)14-4-6-16(20)18(12-14)24-2/h3-6,11-12H,7-10,19-20H2,1-2H3
InChIKey
MSDMHPFTUJFFNZ-UHFFFAOYSA-N
Compound name
4-[4-(4-amino-3-methoxyphenyl)piperazin-1-yl]-2-methoxyaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

37
Patents

328.1899 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 329.197176 180.8
[M+Na]+ 351.179118 186.6
[M-H]- 327.182624 186.8
[M+NH4]+ 346.223723 190.9
[M+K]+ 367.153058 181.8
[M+H-H2O]+ 311.187160 169.9
[M+HCOO]- 373.188101 199.3
[M+CH3COO]- 387.203751 215.4
[M+Na-2H]- 349.164566 181.6
[M]+ 328.18935142 176.9
[M]- 328.19044858 176.9
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