2-[1-(8-methylfuro[2,3-f][1]benzofuran-4-yl)cyclopropyl]acetic acid

C16H14O4 — CID 117428848

IUPAC2-[1-(8-methylfuro[2,3-f][1]benzofuran-4-yl)cyclopropyl]acetic acid
SMILESCc1c2ccoc2c(C2(CC(=O)O)CC2)c2ccoc12
InChIInChI=1S/C16H14O4/c1-9-10-2-6-20-15(10)13(11-3-7-19-14(9)11)16(4-5-16)8-12(17)18/h2-3,6-7H,4-5,8H2,1H3,(H,17,18)
InChIKeyFEGJAHCXFZALGK-UHFFFAOYSA-N
MW270.28 g/mol
LogP3.99
Rot. Bonds3

About 2-[1-(8-methylfuro[2,3-f][1]benzofuran-4-yl)cyclopropyl]acetic acid

2-[1-(8-methylfuro[2,3-f][1]benzofuran-4-yl)cyclopropyl]acetic acid (PubChem CID 117428848) has the molecular formula C16H14O4 and a molecular weight of 270.28 g/mol. Its IUPAC name is 2-[1-(8-methylfuro[2,3-f][1]benzofuran-4-yl)cyclopropyl]acetic acid.

Molecular Properties

Compound Name2-[1-(8-methylfuro[2,3-f][1]benzofuran-4-yl)cyclopropyl]acetic acid
PubChem CID117428848
Molecular FormulaC16H14O4
Molecular Weight270.28 g/mol
Exact Mass270.09
IUPAC Name2-[1-(8-methylfuro[2,3-f][1]benzofuran-4-yl)cyclopropyl]acetic acid
SMILESCc1c2ccoc2c(C2(CC(=O)O)CC2)c2ccoc12
InChIInChI=1S/C16H14O4/c1-9-10-2-6-20-15(10)13(11-3-7-19-14(9)11)16(4-5-16)8-12(17)18/h2-3,6-7H,4-5,8H2,1H3,(H,17,18)
InChIKeyFEGJAHCXFZALGK-UHFFFAOYSA-N
XLogP3.99
TPSA63.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.28
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[1-(8-methylfuro[2,3-f][1]benzofuran-4-yl)cyclopropyl]acetic acid?
The IUPAC name of 2-[1-(8-methylfuro[2,3-f][1]benzofuran-4-yl)cyclopropyl]acetic acid (CID 117428848) is 2-[1-(8-methylfuro[2,3-f][1]benzofuran-4-yl)cyclopropyl]acetic acid.
What is the SMILES notation for 2-[1-(8-methylfuro[2,3-f][1]benzofuran-4-yl)cyclopropyl]acetic acid?
The canonical SMILES for 2-[1-(8-methylfuro[2,3-f][1]benzofuran-4-yl)cyclopropyl]acetic acid is Cc1c2ccoc2c(C2(CC(=O)O)CC2)c2ccoc12.
What is the InChIKey of 2-[1-(8-methylfuro[2,3-f][1]benzofuran-4-yl)cyclopropyl]acetic acid?
The InChIKey is FEGJAHCXFZALGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14O4/c1-9-10-2-6-20-15(10)13(11-3-7-19-14(9)11)16(4-5-16)8-12(17)18/h2-3,6-7H,4-5,8H2,1H3,(H,17,18).
What are the key properties of 2-[1-(8-methylfuro[2,3-f][1]benzofuran-4-yl)cyclopropyl]acetic acid?
2-[1-(8-methylfuro[2,3-f][1]benzofuran-4-yl)cyclopropyl]acetic acid has a molecular weight of 270.28 g/mol, XLogP of 3.99, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(8-methylfuro[2,3-f][1]benzofuran-4-yl)cyclopropyl]acetic acid is sourced from PubChem (CID 117428848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).