CID 3079597

Benzamide, 4-amino-5-chloro-n-(2-(cyclopropylmethylamino)ethyl)-2-methoxy-

Structural Information

Molecular Formula
C14H20ClN3O2
SMILES
CN(CCNC(=O)C1=CC(=C(C=C1OC)N)Cl)C2CC2
InChI
InChI=1S/C14H20ClN3O2/c1-18(9-3-4-9)6-5-17-14(19)10-7-11(15)12(16)8-13(10)20-2/h7-9H,3-6,16H2,1-2H3,(H,17,19)
InChIKey
HBWNVHHLPLJDRF-UHFFFAOYSA-N
Compound name
4-amino-5-chloro-N-[2-[cyclopropyl(methyl)amino]ethyl]-2-methoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

297.1244 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 298.131676 163.1
[M+Na]+ 320.113618 171.0
[M-H]- 296.117124 171.3
[M+NH4]+ 315.158223 174.5
[M+K]+ 336.087558 166.5
[M+H-H2O]+ 280.121660 156.5
[M+HCOO]- 342.122601 184.6
[M+CH3COO]- 356.138251 215.1
[M+Na-2H]- 318.099066 164.9
[M]+ 297.12385142 168.8
[M]- 297.12494858 168.8
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