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]+ 298.13168 163.1
[M+Na]+ 320.11362 171.0
[M-H]- 296.11712 171.3
[M+NH4]+ 315.15822 174.5
[M+K]+ 336.08756 166.5
[M+H-H2O]+ 280.12166 156.5
[M+HCOO]- 342.12260 184.6
[M+CH3COO]- 356.13825 215.1
[M+Na-2H]- 318.09907 164.9
[M]+ 297.12385 168.8
[M]- 297.12495 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