CID 70884

1164-72-3

Structural Information

Molecular Formula
C20H25N3O
SMILES
CC1=CC=C(C=C1)NC2(CCN(CC2)CC3=CC=CC=C3)C(=O)N
InChI
InChI=1S/C20H25N3O/c1-16-7-9-18(10-8-16)22-20(19(21)24)11-13-23(14-12-20)15-17-5-3-2-4-6-17/h2-10,22H,11-15H2,1H3,(H2,21,24)
InChIKey
FTCXTANXUNVWNR-UHFFFAOYSA-N
Compound name
1-benzyl-4-(4-methylanilino)piperidine-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

24
Patents

323.19977 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 324.207046 178.9
[M+Na]+ 346.188988 182.2
[M-H]- 322.192494 185.6
[M+NH4]+ 341.233593 191.9
[M+K]+ 362.162928 177.1
[M+H-H2O]+ 306.197030 168.8
[M+HCOO]- 368.197971 197.8
[M+CH3COO]- 382.213621 212.9
[M+Na-2H]- 344.174436 181.7
[M]+ 323.19922142 172.5
[M]- 323.20031858 172.5
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