1-ethyl-4-[4-(methoxymethyl)phenoxy]benzene

C16H18O2 — CID 170064957

IUPAC1-ethyl-4-[4-(methoxymethyl)phenoxy]benzene
SMILESCCc1ccc(Oc2ccc(COC)cc2)cc1
InChIInChI=1S/C16H18O2/c1-3-13-4-8-15(9-5-13)18-16-10-6-14(7-11-16)12-17-2/h4-11H,3,12H2,1-2H3
InChIKeyWMAPWFPRIOSSEC-UHFFFAOYSA-N
MW242.32 g/mol
LogP4.19
Rot. Bonds5

About 1-ethyl-4-[4-(methoxymethyl)phenoxy]benzene

1-ethyl-4-[4-(methoxymethyl)phenoxy]benzene (PubChem CID 170064957) has the molecular formula C16H18O2 and a molecular weight of 242.32 g/mol. Its IUPAC name is 1-ethyl-4-[4-(methoxymethyl)phenoxy]benzene.

Molecular Properties

Compound Name1-ethyl-4-[4-(methoxymethyl)phenoxy]benzene
PubChem CID170064957
Molecular FormulaC16H18O2
Molecular Weight242.32 g/mol
Exact Mass242.13
IUPAC Name1-ethyl-4-[4-(methoxymethyl)phenoxy]benzene
SMILESCCc1ccc(Oc2ccc(COC)cc2)cc1
InChIInChI=1S/C16H18O2/c1-3-13-4-8-15(9-5-13)18-16-10-6-14(7-11-16)12-17-2/h4-11H,3,12H2,1-2H3
InChIKeyWMAPWFPRIOSSEC-UHFFFAOYSA-N
XLogP4.19
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 54.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-4-[4-(methoxymethyl)phenoxy]benzene?
The IUPAC name of 1-ethyl-4-[4-(methoxymethyl)phenoxy]benzene (CID 170064957) is 1-ethyl-4-[4-(methoxymethyl)phenoxy]benzene.
What is the SMILES notation for 1-ethyl-4-[4-(methoxymethyl)phenoxy]benzene?
The canonical SMILES for 1-ethyl-4-[4-(methoxymethyl)phenoxy]benzene is CCc1ccc(Oc2ccc(COC)cc2)cc1.
What is the InChIKey of 1-ethyl-4-[4-(methoxymethyl)phenoxy]benzene?
The InChIKey is WMAPWFPRIOSSEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18O2/c1-3-13-4-8-15(9-5-13)18-16-10-6-14(7-11-16)12-17-2/h4-11H,3,12H2,1-2H3.
What are the key properties of 1-ethyl-4-[4-(methoxymethyl)phenoxy]benzene?
1-ethyl-4-[4-(methoxymethyl)phenoxy]benzene has a molecular weight of 242.32 g/mol, XLogP of 4.19, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-4-[4-(methoxymethyl)phenoxy]benzene is sourced from PubChem (CID 170064957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).