2-(2-methoxyphenyl)-3-methyl-4-propoxy-1-benzofuran

C19H20O3 — CID 54415251

IUPAC2-(2-methoxyphenyl)-3-methyl-4-propoxy-1-benzofuran
SMILESCCCOc1cccc2oc(-c3ccccc3OC)c(C)c12
InChIInChI=1S/C19H20O3/c1-4-12-21-16-10-7-11-17-18(16)13(2)19(22-17)14-8-5-6-9-15(14)20-3/h5-11H,4,12H2,1-3H3
InChIKeyARBYVSXPRZNZIB-UHFFFAOYSA-N
MW296.37 g/mol
LogP5.21
Rot. Bonds5

About 2-(2-methoxyphenyl)-3-methyl-4-propoxy-1-benzofuran

2-(2-methoxyphenyl)-3-methyl-4-propoxy-1-benzofuran (PubChem CID 54415251) has the molecular formula C19H20O3 and a molecular weight of 296.37 g/mol. Its IUPAC name is 2-(2-methoxyphenyl)-3-methyl-4-propoxy-1-benzofuran.

Molecular Properties

Compound Name2-(2-methoxyphenyl)-3-methyl-4-propoxy-1-benzofuran
PubChem CID54415251
Molecular FormulaC19H20O3
Molecular Weight296.37 g/mol
Exact Mass296.14
IUPAC Name2-(2-methoxyphenyl)-3-methyl-4-propoxy-1-benzofuran
SMILESCCCOc1cccc2oc(-c3ccccc3OC)c(C)c12
InChIInChI=1S/C19H20O3/c1-4-12-21-16-10-7-11-17-18(16)13(2)19(22-17)14-8-5-6-9-15(14)20-3/h5-11H,4,12H2,1-3H3
InChIKeyARBYVSXPRZNZIB-UHFFFAOYSA-N
XLogP5.21
TPSA31.60 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500296.37
LogP ≤ 55.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

[2-[3-[[2-(2-methoxyphenyl)-3-methyl-1-benzofuran-4-yl]oxy]propyl]-3-pyridinyl]methanamine
CID 68655198
ethyl 2-[2-(2-methoxyphenyl)-4-oxochromen-3-yl]acetate
CID 139291625
4-methoxy-3-methyl-1-benzofuran-2-carbaldehyde
CID 82374331
3-methoxy-2-(2-methoxyphenyl)chromen-4-one
CID 676169
2-(2-methoxyphenyl)-1,6-dimethylnaphtho[1,2-g][1]benzofuran-10,11-diol
CID 123661645
2-methyl-3-propoxyaniline
CID 23134606
(2-methoxy-6-propoxyphenyl)methanamine
CID 118156685
3-(2-methoxyphenyl)-1,2-dimethyldibenzofuran
CID 170175004
1-(chloromethoxy)-2-propoxybenzene
CID 79530194
4-[(2-methoxyphenyl)methoxy]-3-methyl-1-benzofuran-2-carboxylic acid
CID 10710216
ethyl 2-(2-methoxyphenyl)-3-methyl-4-oxochromene-8-carboxylate
CID 13288104
2-methoxy-6-(2-propoxyphenyl)-1H-1,3,5-triazine-4-thione
CID 106521583

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyphenyl)-3-methyl-4-propoxy-1-benzofuran?
The IUPAC name of 2-(2-methoxyphenyl)-3-methyl-4-propoxy-1-benzofuran (CID 54415251) is 2-(2-methoxyphenyl)-3-methyl-4-propoxy-1-benzofuran.
What is the SMILES notation for 2-(2-methoxyphenyl)-3-methyl-4-propoxy-1-benzofuran?
The canonical SMILES for 2-(2-methoxyphenyl)-3-methyl-4-propoxy-1-benzofuran is CCCOc1cccc2oc(-c3ccccc3OC)c(C)c12.
What is the InChIKey of 2-(2-methoxyphenyl)-3-methyl-4-propoxy-1-benzofuran?
The InChIKey is ARBYVSXPRZNZIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20O3/c1-4-12-21-16-10-7-11-17-18(16)13(2)19(22-17)14-8-5-6-9-15(14)20-3/h5-11H,4,12H2,1-3H3.
What are the key properties of 2-(2-methoxyphenyl)-3-methyl-4-propoxy-1-benzofuran?
2-(2-methoxyphenyl)-3-methyl-4-propoxy-1-benzofuran has a molecular weight of 296.37 g/mol, XLogP of 5.21, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenyl)-3-methyl-4-propoxy-1-benzofuran is sourced from PubChem (CID 54415251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).