4-methoxy-2-[2-(4-methoxyphenyl)ethyl]-3,6-dihydro-2H-pyran-6-ol

C15H20O4 — CID 134508325

IUPAC4-methoxy-2-[2-(4-methoxyphenyl)ethyl]-3,6-dihydro-2H-pyran-6-ol
SMILESCOC1=CC(O)OC(CCc2ccc(OC)cc2)C1
InChIInChI=1S/C15H20O4/c1-17-12-6-3-11(4-7-12)5-8-13-9-14(18-2)10-15(16)19-13/h3-4,6-7,10,13,15-16H,5,8-9H2,1-2H3
InChIKeyQZPXUNXQUNSQEX-UHFFFAOYSA-N
MW264.32 g/mol
LogP2.27
Rot. Bonds5

About 4-methoxy-2-[2-(4-methoxyphenyl)ethyl]-3,6-dihydro-2H-pyran-6-ol

4-methoxy-2-[2-(4-methoxyphenyl)ethyl]-3,6-dihydro-2H-pyran-6-ol (PubChem CID 134508325) has the molecular formula C15H20O4 and a molecular weight of 264.32 g/mol. Its IUPAC name is 4-methoxy-2-[2-(4-methoxyphenyl)ethyl]-3,6-dihydro-2H-pyran-6-ol.

Molecular Properties

Compound Name4-methoxy-2-[2-(4-methoxyphenyl)ethyl]-3,6-dihydro-2H-pyran-6-ol
PubChem CID134508325
Molecular FormulaC15H20O4
Molecular Weight264.32 g/mol
Exact Mass264.14
IUPAC Name4-methoxy-2-[2-(4-methoxyphenyl)ethyl]-3,6-dihydro-2H-pyran-6-ol
SMILESCOC1=CC(O)OC(CCc2ccc(OC)cc2)C1
InChIInChI=1S/C15H20O4/c1-17-12-6-3-11(4-7-12)5-8-13-9-14(18-2)10-15(16)19-13/h3-4,6-7,10,13,15-16H,5,8-9H2,1-2H3
InChIKeyQZPXUNXQUNSQEX-UHFFFAOYSA-N
XLogP2.27
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-[2-(4-methoxyphenyl)ethyl]-3,6-dihydro-2H-pyran-6-ol?
The IUPAC name of 4-methoxy-2-[2-(4-methoxyphenyl)ethyl]-3,6-dihydro-2H-pyran-6-ol (CID 134508325) is 4-methoxy-2-[2-(4-methoxyphenyl)ethyl]-3,6-dihydro-2H-pyran-6-ol.
What is the SMILES notation for 4-methoxy-2-[2-(4-methoxyphenyl)ethyl]-3,6-dihydro-2H-pyran-6-ol?
The canonical SMILES for 4-methoxy-2-[2-(4-methoxyphenyl)ethyl]-3,6-dihydro-2H-pyran-6-ol is COC1=CC(O)OC(CCc2ccc(OC)cc2)C1.
What is the InChIKey of 4-methoxy-2-[2-(4-methoxyphenyl)ethyl]-3,6-dihydro-2H-pyran-6-ol?
The InChIKey is QZPXUNXQUNSQEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20O4/c1-17-12-6-3-11(4-7-12)5-8-13-9-14(18-2)10-15(16)19-13/h3-4,6-7,10,13,15-16H,5,8-9H2,1-2H3.
What are the key properties of 4-methoxy-2-[2-(4-methoxyphenyl)ethyl]-3,6-dihydro-2H-pyran-6-ol?
4-methoxy-2-[2-(4-methoxyphenyl)ethyl]-3,6-dihydro-2H-pyran-6-ol has a molecular weight of 264.32 g/mol, XLogP of 2.27, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-[2-(4-methoxyphenyl)ethyl]-3,6-dihydro-2H-pyran-6-ol is sourced from PubChem (CID 134508325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).