2-(4-acetylphenoxy)-N-dibenzofuran-2-ylacetamide

C22H17NO4 — CID 2635783

IUPAC2-(4-acetylphenoxy)-N-dibenzofuran-2-ylacetamide
SMILESCC(=O)c1ccc(OCC(=O)Nc2ccc3oc4ccccc4c3c2)cc1
InChIInChI=1S/C22H17NO4/c1-14(24)15-6-9-17(10-7-15)26-13-22(25)23-16-8-11-21-19(12-16)18-4-2-3-5-20(18)27-21/h2-12H,13H2,1H3,(H,23,25)
InChIKeyUXLKFWCSXAPJSX-UHFFFAOYSA-N
MW359.38 g/mol
LogP4.81
Rot. Bonds5

About 2-(4-acetylphenoxy)-N-dibenzofuran-2-ylacetamide

2-(4-acetylphenoxy)-N-dibenzofuran-2-ylacetamide (PubChem CID 2635783) has the molecular formula C22H17NO4 and a molecular weight of 359.38 g/mol. Its IUPAC name is 2-(4-acetylphenoxy)-N-dibenzofuran-2-ylacetamide.

Molecular Properties

Compound Name2-(4-acetylphenoxy)-N-dibenzofuran-2-ylacetamide
PubChem CID2635783
Molecular FormulaC22H17NO4
Molecular Weight359.38 g/mol
Exact Mass359.12
IUPAC Name2-(4-acetylphenoxy)-N-dibenzofuran-2-ylacetamide
SMILESCC(=O)c1ccc(OCC(=O)Nc2ccc3oc4ccccc4c3c2)cc1
InChIInChI=1S/C22H17NO4/c1-14(24)15-6-9-17(10-7-15)26-13-22(25)23-16-8-11-21-19(12-16)18-4-2-3-5-20(18)27-21/h2-12H,13H2,1H3,(H,23,25)
InChIKeyUXLKFWCSXAPJSX-UHFFFAOYSA-N
XLogP4.81
TPSA68.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.38
LogP ≤ 54.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-acetylphenoxy)-N-dibenzofuran-2-ylacetamide?
The IUPAC name of 2-(4-acetylphenoxy)-N-dibenzofuran-2-ylacetamide (CID 2635783) is 2-(4-acetylphenoxy)-N-dibenzofuran-2-ylacetamide.
What is the SMILES notation for 2-(4-acetylphenoxy)-N-dibenzofuran-2-ylacetamide?
The canonical SMILES for 2-(4-acetylphenoxy)-N-dibenzofuran-2-ylacetamide is CC(=O)c1ccc(OCC(=O)Nc2ccc3oc4ccccc4c3c2)cc1.
What is the InChIKey of 2-(4-acetylphenoxy)-N-dibenzofuran-2-ylacetamide?
The InChIKey is UXLKFWCSXAPJSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17NO4/c1-14(24)15-6-9-17(10-7-15)26-13-22(25)23-16-8-11-21-19(12-16)18-4-2-3-5-20(18)27-21/h2-12H,13H2,1H3,(H,23,25).
What are the key properties of 2-(4-acetylphenoxy)-N-dibenzofuran-2-ylacetamide?
2-(4-acetylphenoxy)-N-dibenzofuran-2-ylacetamide has a molecular weight of 359.38 g/mol, XLogP of 4.81, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-acetylphenoxy)-N-dibenzofuran-2-ylacetamide is sourced from PubChem (CID 2635783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).