5,5-diphenyl-2-(2-piperidin-1-ylethyl)-1,3-dioxolan-4-one

C22H25NO3 — CID 28932

💊View drug profile → pipoxolan
IUPAC5,5-diphenyl-2-(2-piperidin-1-ylethyl)-1,3-dioxolan-4-one
SMILESO=C1OC(CCN2CCCCC2)OC1(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H25NO3/c24-21-22(18-10-4-1-5-11-18,19-12-6-2-7-13-19)26-20(25-21)14-17-23-15-8-3-9-16-23/h1-2,4-7,10-13,20H,3,8-9,14-17H2
InChIKeyDXSUDONPFZKWOO-UHFFFAOYSA-N
MW351.45 g/mol
LogP3.71
Rot. Bonds5

About 5,5-diphenyl-2-(2-piperidin-1-ylethyl)-1,3-dioxolan-4-one

5,5-diphenyl-2-(2-piperidin-1-ylethyl)-1,3-dioxolan-4-one (PubChem CID 28932) has the molecular formula C22H25NO3 and a molecular weight of 351.45 g/mol. Its IUPAC name is 5,5-diphenyl-2-(2-piperidin-1-ylethyl)-1,3-dioxolan-4-one.

Molecular Properties

Compound Name5,5-diphenyl-2-(2-piperidin-1-ylethyl)-1,3-dioxolan-4-one
PubChem CID28932
Molecular FormulaC22H25NO3
Molecular Weight351.45 g/mol
Exact Mass351.18
IUPAC Name5,5-diphenyl-2-(2-piperidin-1-ylethyl)-1,3-dioxolan-4-one
SMILESO=C1OC(CCN2CCCCC2)OC1(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H25NO3/c24-21-22(18-10-4-1-5-11-18,19-12-6-2-7-13-19)26-20(25-21)14-17-23-15-8-3-9-16-23/h1-2,4-7,10-13,20H,3,8-9,14-17H2
InChIKeyDXSUDONPFZKWOO-UHFFFAOYSA-N
XLogP3.71
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.45
LogP ≤ 53.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 5,5-diphenyl-2-(2-piperidin-1-ylethyl)-1,3-dioxolan-4-one 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

Propiverine
CID 4942
1-Methyl-4-piperidyl benzilate
CID 77157
Pipoxolan Hydrochloride
CID 28931
Propiverine Hydrochloride
CID 441412
(1-Ethylpiperidin-4-yl) 2-hydroxy-2,2-diphenylacetate
CID 15636667
8,8-Dimethyl-3,3-diphenyl-1,4-dioxa-8-azoniaspiro[4.5]decan-2-one iodide
CID 12872436
N-fluoroethyl-4-piperidinyl benzilate
CID 10043883
[1-(3-Fluoropropyl)piperidin-4-yl] 2-hydroxy-2,2-diphenylacetate
CID 10547203
(1-Propylpiperidin-4-yl) 2-hydroxy-2,2-diphenylacetate
CID 15636668
Diphenylpropoxyacetic acid 1-methyl-4-piperidyl ester hydrochloride
CID 41125
[1-(2-(18F)fluoroethyl)piperidin-4-yl] 2-hydroxy-2,2-diphenylacetate
CID 450866
Acetic acid, 2,2-diphenyl-2-ethoxy-, (3-(diethylamino)propyl) ester, hydrochloride
CID 2830874

Frequently Asked Questions

What is the IUPAC name of 5,5-diphenyl-2-(2-piperidin-1-ylethyl)-1,3-dioxolan-4-one?
The IUPAC name of 5,5-diphenyl-2-(2-piperidin-1-ylethyl)-1,3-dioxolan-4-one (CID 28932) is 5,5-diphenyl-2-(2-piperidin-1-ylethyl)-1,3-dioxolan-4-one.
What is the SMILES notation for 5,5-diphenyl-2-(2-piperidin-1-ylethyl)-1,3-dioxolan-4-one?
The canonical SMILES for 5,5-diphenyl-2-(2-piperidin-1-ylethyl)-1,3-dioxolan-4-one is O=C1OC(CCN2CCCCC2)OC1(c1ccccc1)c1ccccc1.
What is the InChIKey of 5,5-diphenyl-2-(2-piperidin-1-ylethyl)-1,3-dioxolan-4-one?
The InChIKey is DXSUDONPFZKWOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25NO3/c24-21-22(18-10-4-1-5-11-18,19-12-6-2-7-13-19)26-20(25-21)14-17-23-15-8-3-9-16-23/h1-2,4-7,10-13,20H,3,8-9,14-17H2.
What are the key properties of 5,5-diphenyl-2-(2-piperidin-1-ylethyl)-1,3-dioxolan-4-one?
5,5-diphenyl-2-(2-piperidin-1-ylethyl)-1,3-dioxolan-4-one has a molecular weight of 351.45 g/mol, XLogP of 3.71, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-diphenyl-2-(2-piperidin-1-ylethyl)-1,3-dioxolan-4-one is sourced from PubChem (CID 28932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).