2-[2-(2,6-dimethoxyphenoxy)ethyl]-1,3-dioxane

C14H20O5 — CID 66473547

IUPAC2-[2-(2,6-dimethoxyphenoxy)ethyl]-1,3-dioxane
SMILESCOc1cccc(OC)c1OCCC1OCCCO1
InChIInChI=1S/C14H20O5/c1-15-11-5-3-6-12(16-2)14(11)19-10-7-13-17-8-4-9-18-13/h3,5-6,13H,4,7-10H2,1-2H3
InChIKeyRINFOMORRMGFNO-UHFFFAOYSA-N
MW268.31 g/mol
LogP2.24
Rot. Bonds6

About 2-[2-(2,6-dimethoxyphenoxy)ethyl]-1,3-dioxane

2-[2-(2,6-dimethoxyphenoxy)ethyl]-1,3-dioxane (PubChem CID 66473547) has the molecular formula C14H20O5 and a molecular weight of 268.31 g/mol. Its IUPAC name is 2-[2-(2,6-dimethoxyphenoxy)ethyl]-1,3-dioxane.

Molecular Properties

Compound Name2-[2-(2,6-dimethoxyphenoxy)ethyl]-1,3-dioxane
PubChem CID66473547
Molecular FormulaC14H20O5
Molecular Weight268.31 g/mol
Exact Mass268.13
IUPAC Name2-[2-(2,6-dimethoxyphenoxy)ethyl]-1,3-dioxane
SMILESCOc1cccc(OC)c1OCCC1OCCCO1
InChIInChI=1S/C14H20O5/c1-15-11-5-3-6-12(16-2)14(11)19-10-7-13-17-8-4-9-18-13/h3,5-6,13H,4,7-10H2,1-2H3
InChIKeyRINFOMORRMGFNO-UHFFFAOYSA-N
XLogP2.24
TPSA46.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.31
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2-[2-(2,6-dimethoxyphenoxy)ethyl]-1,3-dioxane 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

2-[2-(2-methylphenoxy)ethyl]-1,3-dioxane
CID 66475164
1-[[2-[2-(1,3-dioxolan-2-yl)ethoxy]-3-methoxyphenyl]methyl]-2-phenylhydrazine
CID 169386244
3-[2-(2,6-dimethoxyphenoxy)ethyl]azetidine
CID 107391518
2-[2-(2,6-dichlorophenoxy)ethyl]-1,3-dioxolane
CID 82091052
(1R)-3-(1,3-dioxan-2-yl)-1-(2-methoxyphenyl)propan-1-ol
CID 97293200
2-[2-[2-(1,3-dioxan-2-yl)ethoxy]phenyl]ethanol
CID 107712859
1-[4-(2,6-dimethoxyphenoxy)butyl]piperidin-1-ium
CID 2262417
N-[2-(1,3-dioxan-2-yl)ethyl]-2-methoxy-N-methylaniline
CID 66472307
2-[2-(2-methoxyphenyl)sulfonylethyl]-1,3-dioxane
CID 66474370
[3-methoxy-2-[3-(oxolan-2-yl)propoxy]phenyl]methanamine
CID 65158689
4-[2-[2-(1,3-dioxolan-2-yl)ethoxy]-3-methoxyphenyl]-6-methyl-2-oxo-1H-pyridine-3-carbonitrile
CID 168586409
3-[2-(2,6-dimethoxyphenoxy)ethyl]piperidine
CID 62356017

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2,6-dimethoxyphenoxy)ethyl]-1,3-dioxane?
The IUPAC name of 2-[2-(2,6-dimethoxyphenoxy)ethyl]-1,3-dioxane (CID 66473547) is 2-[2-(2,6-dimethoxyphenoxy)ethyl]-1,3-dioxane.
What is the SMILES notation for 2-[2-(2,6-dimethoxyphenoxy)ethyl]-1,3-dioxane?
The canonical SMILES for 2-[2-(2,6-dimethoxyphenoxy)ethyl]-1,3-dioxane is COc1cccc(OC)c1OCCC1OCCCO1.
What is the InChIKey of 2-[2-(2,6-dimethoxyphenoxy)ethyl]-1,3-dioxane?
The InChIKey is RINFOMORRMGFNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20O5/c1-15-11-5-3-6-12(16-2)14(11)19-10-7-13-17-8-4-9-18-13/h3,5-6,13H,4,7-10H2,1-2H3.
What are the key properties of 2-[2-(2,6-dimethoxyphenoxy)ethyl]-1,3-dioxane?
2-[2-(2,6-dimethoxyphenoxy)ethyl]-1,3-dioxane has a molecular weight of 268.31 g/mol, XLogP of 2.24, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2,6-dimethoxyphenoxy)ethyl]-1,3-dioxane is sourced from PubChem (CID 66473547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).