CID 18112

Butyramide, 2-phenyl-4-piperidino-2-(2-piperidinoethyl)-

Structural Information

Molecular Formula
C22H35N3O
SMILES
C1CCN(CC1)CCC(CCN2CCCCC2)(C3=CC=CC=C3)C(=O)N
InChI
InChI=1S/C22H35N3O/c23-21(26)22(20-10-4-1-5-11-20,12-18-24-14-6-2-7-15-24)13-19-25-16-8-3-9-17-25/h1,4-5,10-11H,2-3,6-9,12-19H2,(H2,23,26)
InChIKey
TXSYVXMEIWQHCF-UHFFFAOYSA-N
Compound name
2-phenyl-4-piperidin-1-yl-2-(2-piperidin-1-ylethyl)butanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

357.278 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 358.285276 190.5
[M+Na]+ 380.267218 188.0
[M-H]- 356.270724 193.3
[M+NH4]+ 375.311823 198.1
[M+K]+ 396.241158 183.0
[M+H-H2O]+ 340.275260 179.0
[M+HCOO]- 402.276201 200.3
[M+CH3COO]- 416.291851 216.0
[M+Na-2H]- 378.252666 190.1
[M]+ 357.27745142 179.9
[M]- 357.27854858 179.9
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

No patent data available for this compound.