4-methoxy-5-methyl-6H-furo[3,4-g][1]benzofuran-8-one

C12H10O4 — CID 11687183

IUPAC4-methoxy-5-methyl-6H-furo[3,4-g][1]benzofuran-8-one
SMILESCOc1c(C)c2c(c3occc13)C(=O)OC2
InChIInChI=1S/C12H10O4/c1-6-8-5-16-12(13)9(8)11-7(3-4-15-11)10(6)14-2/h3-4H,5H2,1-2H3
InChIKeyPWVJUFRLWBDUCL-UHFFFAOYSA-N
MW218.21 g/mol
LogP2.42
Rot. Bonds1

About 4-methoxy-5-methyl-6H-furo[3,4-g][1]benzofuran-8-one

4-methoxy-5-methyl-6H-furo[3,4-g][1]benzofuran-8-one (PubChem CID 11687183) has the molecular formula C12H10O4 and a molecular weight of 218.21 g/mol. Its IUPAC name is 4-methoxy-5-methyl-6H-furo[3,4-g][1]benzofuran-8-one.

Molecular Properties

Compound Name4-methoxy-5-methyl-6H-furo[3,4-g][1]benzofuran-8-one
PubChem CID11687183
Molecular FormulaC12H10O4
Molecular Weight218.21 g/mol
Exact Mass218.06
IUPAC Name4-methoxy-5-methyl-6H-furo[3,4-g][1]benzofuran-8-one
SMILESCOc1c(C)c2c(c3occc13)C(=O)OC2
InChIInChI=1S/C12H10O4/c1-6-8-5-16-12(13)9(8)11-7(3-4-15-11)10(6)14-2/h3-4H,5H2,1-2H3
InChIKeyPWVJUFRLWBDUCL-UHFFFAOYSA-N
XLogP2.42
TPSA48.67 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.21
LogP ≤ 52.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 4-methoxy-5-methyl-6H-furo[3,4-g][1]benzofuran-8-one 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

5,7-dihydroxy-6-methoxy-4-methyl-3H-2-benzofuran-1-one
CID 156582406
(5-ethyl-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-4-yl) formate
CID 167079664
7-hydroxy-5-methoxy-4-methyl-6-(3-methylbut-2-enyl)-3H-2-benzofuran-1-one
CID 11118869
ethane;8-methoxy-7-methylfuro[3,2-c]oxepine-4,6-dione
CID 153362051
7-chloro-4,5,6-trimethoxy-3H-2-benzofuran-1-one
CID 121222156
4,7,7,9-tetramethoxy-6H-furo[3,2-g]chromen-5-one
CID 70470330
5-hydroxy-7-methoxy-6-methyl-1-oxo-3H-2-benzofuran-4-carbaldehyde
CID 19901298
N-(4-bromophenyl)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enamide
CID 71963780
4-methoxy-9-(4-methoxyphenyl)-6,7-dimethyl-3H-benzo[f][2]benzofuran-1-one
CID 118529990
2-[6-methoxy-7-methyl-3-oxo-4-(2-trimethylsilylethoxy)-1H-2-benzofuran-5-yl]acetaldehyde
CID 57478686
7-hydroxy-6-[(E)-4-iodo-3-methylbut-2-enyl]-5-methoxy-4-methyl-3H-2-benzofuran-1-one
CID 142962688
6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-2-methylhex-4-enoic acid
CID 67735201

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-5-methyl-6H-furo[3,4-g][1]benzofuran-8-one?
The IUPAC name of 4-methoxy-5-methyl-6H-furo[3,4-g][1]benzofuran-8-one (CID 11687183) is 4-methoxy-5-methyl-6H-furo[3,4-g][1]benzofuran-8-one.
What is the SMILES notation for 4-methoxy-5-methyl-6H-furo[3,4-g][1]benzofuran-8-one?
The canonical SMILES for 4-methoxy-5-methyl-6H-furo[3,4-g][1]benzofuran-8-one is COc1c(C)c2c(c3occc13)C(=O)OC2.
What is the InChIKey of 4-methoxy-5-methyl-6H-furo[3,4-g][1]benzofuran-8-one?
The InChIKey is PWVJUFRLWBDUCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10O4/c1-6-8-5-16-12(13)9(8)11-7(3-4-15-11)10(6)14-2/h3-4H,5H2,1-2H3.
What are the key properties of 4-methoxy-5-methyl-6H-furo[3,4-g][1]benzofuran-8-one?
4-methoxy-5-methyl-6H-furo[3,4-g][1]benzofuran-8-one has a molecular weight of 218.21 g/mol, XLogP of 2.42, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-5-methyl-6H-furo[3,4-g][1]benzofuran-8-one is sourced from PubChem (CID 11687183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).