1-(1-benzofuran-2-yl)-2-cyclobutyloxyethanone

C14H14O3 — CID 62141411

IUPAC1-(1-benzofuran-2-yl)-2-cyclobutyloxyethanone
SMILESO=C(COC1CCC1)c1cc2ccccc2o1
InChIInChI=1S/C14H14O3/c15-12(9-16-11-5-3-6-11)14-8-10-4-1-2-7-13(10)17-14/h1-2,4,7-8,11H,3,5-6,9H2
InChIKeyJGEHPCVWYFNYGC-UHFFFAOYSA-N
MW230.26 g/mol
LogP3.18
Rot. Bonds4

About 1-(1-benzofuran-2-yl)-2-cyclobutyloxyethanone

1-(1-benzofuran-2-yl)-2-cyclobutyloxyethanone (PubChem CID 62141411) has the molecular formula C14H14O3 and a molecular weight of 230.26 g/mol. Its IUPAC name is 1-(1-benzofuran-2-yl)-2-cyclobutyloxyethanone.

Molecular Properties

Compound Name1-(1-benzofuran-2-yl)-2-cyclobutyloxyethanone
PubChem CID62141411
Molecular FormulaC14H14O3
Molecular Weight230.26 g/mol
Exact Mass230.09
IUPAC Name1-(1-benzofuran-2-yl)-2-cyclobutyloxyethanone
SMILESO=C(COC1CCC1)c1cc2ccccc2o1
InChIInChI=1S/C14H14O3/c15-12(9-16-11-5-3-6-11)14-8-10-4-1-2-7-13(10)17-14/h1-2,4,7-8,11H,3,5-6,9H2
InChIKeyJGEHPCVWYFNYGC-UHFFFAOYSA-N
XLogP3.18
TPSA39.44 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.26
LogP ≤ 53.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-(1-benzofuran-2-yl)-2-cyclobutyloxyethanone 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

1-(1-benzofuran-2-yl)-2-ethoxyethanone
CID 43799572
1-(1-benzofuran-2-yl)-2-(2-chlorophenoxy)ethanone
CID 7816108
N-(1-benzofuran-2-ylmethyl)-2-cyclohexyloxyacetamide
CID 87001290
1-(5-methyl-1-benzofuran-2-yl)-2-piperidin-4-yloxyethanone
CID 114736583
3-amino-1-(1-benzofuran-2-yl)propan-1-one
CID 82275110
1-(1-benzofuran-2-yl)-2-(2-phenylethoxy)ethanone
CID 43800797
1-(1-benzofuran-2-yl)-2-[(2S)-piperidin-2-yl]ethanone
CID 129368395
[2-(1-benzofuran-2-yl)-2-oxoethyl] 1-phenylcyclopentane-1-carboxylate
CID 8611527
1-(1-benzofuran-2-yl)-2-(3,5-dichlorophenoxy)ethanone
CID 60623980
1-(1-benzofuran-2-yl)-2-(4-fluorophenoxy)ethanone
CID 43413232
1-(1-benzofuran-2-yl)-2-[cyclobutylmethyl(ethyl)amino]ethanone
CID 107399870
1-(1-benzofuran-2-yl)-2-[2-(hydroxymethyl)-3-methylpyrrolidin-1-yl]ethanone
CID 102782504

Frequently Asked Questions

What is the IUPAC name of 1-(1-benzofuran-2-yl)-2-cyclobutyloxyethanone?
The IUPAC name of 1-(1-benzofuran-2-yl)-2-cyclobutyloxyethanone (CID 62141411) is 1-(1-benzofuran-2-yl)-2-cyclobutyloxyethanone.
What is the SMILES notation for 1-(1-benzofuran-2-yl)-2-cyclobutyloxyethanone?
The canonical SMILES for 1-(1-benzofuran-2-yl)-2-cyclobutyloxyethanone is O=C(COC1CCC1)c1cc2ccccc2o1.
What is the InChIKey of 1-(1-benzofuran-2-yl)-2-cyclobutyloxyethanone?
The InChIKey is JGEHPCVWYFNYGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14O3/c15-12(9-16-11-5-3-6-11)14-8-10-4-1-2-7-13(10)17-14/h1-2,4,7-8,11H,3,5-6,9H2.
What are the key properties of 1-(1-benzofuran-2-yl)-2-cyclobutyloxyethanone?
1-(1-benzofuran-2-yl)-2-cyclobutyloxyethanone has a molecular weight of 230.26 g/mol, XLogP of 3.18, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-benzofuran-2-yl)-2-cyclobutyloxyethanone is sourced from PubChem (CID 62141411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).