2-(4-methoxyphenyl)-5-methylfuran

C12H12O2 — CID 11171456

IUPAC2-(4-methoxyphenyl)-5-methylfuran
SMILESCOc1ccc(-c2ccc(C)o2)cc1
InChIInChI=1S/C12H12O2/c1-9-3-8-12(14-9)10-4-6-11(13-2)7-5-10/h3-8H,1-2H3
InChIKeyVGNQAMZSPMXRNI-UHFFFAOYSA-N
MW188.23 g/mol
LogP3.26
Rot. Bonds2

About 2-(4-methoxyphenyl)-5-methylfuran

2-(4-methoxyphenyl)-5-methylfuran (PubChem CID 11171456) has the molecular formula C12H12O2 and a molecular weight of 188.23 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-5-methylfuran.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-5-methylfuran
PubChem CID11171456
Molecular FormulaC12H12O2
Molecular Weight188.23 g/mol
Exact Mass188.08
IUPAC Name2-(4-methoxyphenyl)-5-methylfuran
SMILESCOc1ccc(-c2ccc(C)o2)cc1
InChIInChI=1S/C12H12O2/c1-9-3-8-12(14-9)10-4-6-11(13-2)7-5-10/h3-8H,1-2H3
InChIKeyVGNQAMZSPMXRNI-UHFFFAOYSA-N
XLogP3.26
TPSA22.37 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 53.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-5-methylfuran?
The IUPAC name of 2-(4-methoxyphenyl)-5-methylfuran (CID 11171456) is 2-(4-methoxyphenyl)-5-methylfuran.
What is the SMILES notation for 2-(4-methoxyphenyl)-5-methylfuran?
The canonical SMILES for 2-(4-methoxyphenyl)-5-methylfuran is COc1ccc(-c2ccc(C)o2)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-5-methylfuran?
The InChIKey is VGNQAMZSPMXRNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12O2/c1-9-3-8-12(14-9)10-4-6-11(13-2)7-5-10/h3-8H,1-2H3.
What are the key properties of 2-(4-methoxyphenyl)-5-methylfuran?
2-(4-methoxyphenyl)-5-methylfuran has a molecular weight of 188.23 g/mol, XLogP of 3.26, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-5-methylfuran is sourced from PubChem (CID 11171456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).