2-[2-(4-methoxyphenyl)prop-2-enoxy]oxane

C15H20O3 — CID 11265153

IUPAC2-[2-(4-methoxyphenyl)prop-2-enoxy]oxane
SMILESC=C(COC1CCCCO1)c1ccc(OC)cc1
InChIInChI=1S/C15H20O3/c1-12(11-18-15-5-3-4-10-17-15)13-6-8-14(16-2)9-7-13/h6-9,15H,1,3-5,10-11H2,2H3
InChIKeyIJNOLPCBJCKOTL-UHFFFAOYSA-N
MW248.32 g/mol
LogP3.25
Rot. Bonds5

About 2-[2-(4-methoxyphenyl)prop-2-enoxy]oxane

2-[2-(4-methoxyphenyl)prop-2-enoxy]oxane (PubChem CID 11265153) has the molecular formula C15H20O3 and a molecular weight of 248.32 g/mol. Its IUPAC name is 2-[2-(4-methoxyphenyl)prop-2-enoxy]oxane.

Molecular Properties

Compound Name2-[2-(4-methoxyphenyl)prop-2-enoxy]oxane
PubChem CID11265153
Molecular FormulaC15H20O3
Molecular Weight248.32 g/mol
Exact Mass248.14
IUPAC Name2-[2-(4-methoxyphenyl)prop-2-enoxy]oxane
SMILESC=C(COC1CCCCO1)c1ccc(OC)cc1
InChIInChI=1S/C15H20O3/c1-12(11-18-15-5-3-4-10-17-15)13-6-8-14(16-2)9-7-13/h6-9,15H,1,3-5,10-11H2,2H3
InChIKeyIJNOLPCBJCKOTL-UHFFFAOYSA-N
XLogP3.25
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.32
LogP ≤ 53.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-methoxyphenyl)prop-2-enoxy]oxane?
The IUPAC name of 2-[2-(4-methoxyphenyl)prop-2-enoxy]oxane (CID 11265153) is 2-[2-(4-methoxyphenyl)prop-2-enoxy]oxane.
What is the SMILES notation for 2-[2-(4-methoxyphenyl)prop-2-enoxy]oxane?
The canonical SMILES for 2-[2-(4-methoxyphenyl)prop-2-enoxy]oxane is C=C(COC1CCCCO1)c1ccc(OC)cc1.
What is the InChIKey of 2-[2-(4-methoxyphenyl)prop-2-enoxy]oxane?
The InChIKey is IJNOLPCBJCKOTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20O3/c1-12(11-18-15-5-3-4-10-17-15)13-6-8-14(16-2)9-7-13/h6-9,15H,1,3-5,10-11H2,2H3.
What are the key properties of 2-[2-(4-methoxyphenyl)prop-2-enoxy]oxane?
2-[2-(4-methoxyphenyl)prop-2-enoxy]oxane has a molecular weight of 248.32 g/mol, XLogP of 3.25, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-methoxyphenyl)prop-2-enoxy]oxane is sourced from PubChem (CID 11265153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).