CID 43448268

3-amino-4-(2-methyl-1-piperidinyl)benzamide

Structural Information

Molecular Formula
C13H19N3O
SMILES
CC1CCCCN1C2=C(C=C(C=C2)C(=O)N)N
InChI
InChI=1S/C13H19N3O/c1-9-4-2-3-7-16(9)12-6-5-10(13(15)17)8-11(12)14/h5-6,8-9H,2-4,7,14H2,1H3,(H2,15,17)
InChIKey
BKZDWTZMQYSIDZ-UHFFFAOYSA-N
Compound name
3-amino-4-(2-methylpiperidin-1-yl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

233.15282 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 234.16010 155.3
[M+Na]+ 256.14204 160.4
[M-H]- 232.14554 159.3
[M+NH4]+ 251.18664 170.7
[M+K]+ 272.11598 156.9
[M+H-H2O]+ 216.15008 147.2
[M+HCOO]- 278.15102 174.6
[M+CH3COO]- 292.16667 197.0
[M+Na-2H]- 254.12749 156.3
[M]+ 233.15227 148.2
[M]- 233.15337 148.2
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.