[4-(1-benzylpiperidin-4-yl)oxypiperidin-1-yl]-(2,6-difluorophenyl)methanone

C24H28F2N2O2 — CID 91916473

IUPAC[4-(1-benzylpiperidin-4-yl)oxypiperidin-1-yl]-(2,6-difluorophenyl)methanone
SMILESO=C(c1c(F)cccc1F)N1CCC(OC2CCN(Cc3ccccc3)CC2)CC1
InChIInChI=1S/C24H28F2N2O2/c25-21-7-4-8-22(26)23(21)24(29)28-15-11-20(12-16-28)30-19-9-13-27(14-10-19)17-18-5-2-1-3-6-18/h1-8,19-20H,9-17H2
InChIKeyHFUBFYRQMFDREI-UHFFFAOYSA-N
MW414.50 g/mol
LogP4.25
Rot. Bonds5

About [4-(1-benzylpiperidin-4-yl)oxypiperidin-1-yl]-(2,6-difluorophenyl)methanone

[4-(1-benzylpiperidin-4-yl)oxypiperidin-1-yl]-(2,6-difluorophenyl)methanone (PubChem CID 91916473) has the molecular formula C24H28F2N2O2 and a molecular weight of 414.50 g/mol. Its IUPAC name is [4-(1-benzylpiperidin-4-yl)oxypiperidin-1-yl]-(2,6-difluorophenyl)methanone.

Molecular Properties

Compound Name[4-(1-benzylpiperidin-4-yl)oxypiperidin-1-yl]-(2,6-difluorophenyl)methanone
PubChem CID91916473
Molecular FormulaC24H28F2N2O2
Molecular Weight414.50 g/mol
Exact Mass414.21
IUPAC Name[4-(1-benzylpiperidin-4-yl)oxypiperidin-1-yl]-(2,6-difluorophenyl)methanone
SMILESO=C(c1c(F)cccc1F)N1CCC(OC2CCN(Cc3ccccc3)CC2)CC1
InChIInChI=1S/C24H28F2N2O2/c25-21-7-4-8-22(26)23(21)24(29)28-15-11-20(12-16-28)30-19-9-13-27(14-10-19)17-18-5-2-1-3-6-18/h1-8,19-20H,9-17H2
InChIKeyHFUBFYRQMFDREI-UHFFFAOYSA-N
XLogP4.25
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500414.50
LogP ≤ 54.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze [4-(1-benzylpiperidin-4-yl)oxypiperidin-1-yl]-(2,6-difluorophenyl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N,N'-dibenzoylpiperazine
CID 80185
(4-Benzylpiperidin-1-yl)(2-fluorophenyl)methanone
CID 667749
N,N-dibenzyl-2,6-difluorobenzamide
CID 2321718
[4-(4-Fluoro-benzoyl)-piperidin-1-yl]-phenyl-methanone
CID 1437062
[4-(4-Fluoro-benzoyl)-piperidin-1-yl]-(4-fluoro-phenyl)-methanone
CID 1437837
N-(2-Fluorobenzoyl)morpholine
CID 531931
N-(4-Fluorobenzoyl)morpholine
CID 531951
(2,6-Difluoro-phenyl)-[4-(4-fluoro-benzoyl)-piperidin-1-yl]-methanone
CID 1438295
(3-Fluorophenyl)[3-(piperidin-1-ylcarbonyl)piperidin-1-yl]methanone
CID 3769094
(4-Fluorophenyl)[3-(piperidin-1-ylcarbonyl)piperidin-1-yl]methanone
CID 3791194
[4-(2,6-Dimethylmorpholin-4-yl)piperidin-1-yl]-phenylmethanone
CID 660329
4-Fluorophenyl 4-morpholin-4-ylpiperidyl ketone
CID 754216

Frequently Asked Questions

What is the IUPAC name of [4-(1-benzylpiperidin-4-yl)oxypiperidin-1-yl]-(2,6-difluorophenyl)methanone?
The IUPAC name of [4-(1-benzylpiperidin-4-yl)oxypiperidin-1-yl]-(2,6-difluorophenyl)methanone (CID 91916473) is [4-(1-benzylpiperidin-4-yl)oxypiperidin-1-yl]-(2,6-difluorophenyl)methanone.
What is the SMILES notation for [4-(1-benzylpiperidin-4-yl)oxypiperidin-1-yl]-(2,6-difluorophenyl)methanone?
The canonical SMILES for [4-(1-benzylpiperidin-4-yl)oxypiperidin-1-yl]-(2,6-difluorophenyl)methanone is O=C(c1c(F)cccc1F)N1CCC(OC2CCN(Cc3ccccc3)CC2)CC1.
What is the InChIKey of [4-(1-benzylpiperidin-4-yl)oxypiperidin-1-yl]-(2,6-difluorophenyl)methanone?
The InChIKey is HFUBFYRQMFDREI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28F2N2O2/c25-21-7-4-8-22(26)23(21)24(29)28-15-11-20(12-16-28)30-19-9-13-27(14-10-19)17-18-5-2-1-3-6-18/h1-8,19-20H,9-17H2.
What are the key properties of [4-(1-benzylpiperidin-4-yl)oxypiperidin-1-yl]-(2,6-difluorophenyl)methanone?
[4-(1-benzylpiperidin-4-yl)oxypiperidin-1-yl]-(2,6-difluorophenyl)methanone has a molecular weight of 414.50 g/mol, XLogP of 4.25, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(1-benzylpiperidin-4-yl)oxypiperidin-1-yl]-(2,6-difluorophenyl)methanone is sourced from PubChem (CID 91916473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).