2-benzo[e][1]benzofuran-1-yl-N-[3-(1,3-oxazol-5-yl)phenyl]acetamide

C23H16N2O3 — CID 55833347

IUPAC2-benzo[e][1]benzofuran-1-yl-N-[3-(1,3-oxazol-5-yl)phenyl]acetamide
SMILESO=C(Cc1coc2ccc3ccccc3c12)Nc1cccc(-c2cnco2)c1
InChIInChI=1S/C23H16N2O3/c26-22(25-18-6-3-5-16(10-18)21-12-24-14-28-21)11-17-13-27-20-9-8-15-4-1-2-7-19(15)23(17)20/h1-10,12-14H,11H2,(H,25,26)
InChIKeyXNXPWYXHIJELHL-UHFFFAOYSA-N
MW368.39 g/mol
LogP5.42
Rot. Bonds4

About 2-benzo[e][1]benzofuran-1-yl-N-[3-(1,3-oxazol-5-yl)phenyl]acetamide

2-benzo[e][1]benzofuran-1-yl-N-[3-(1,3-oxazol-5-yl)phenyl]acetamide (PubChem CID 55833347) has the molecular formula C23H16N2O3 and a molecular weight of 368.39 g/mol. Its IUPAC name is 2-benzo[e][1]benzofuran-1-yl-N-[3-(1,3-oxazol-5-yl)phenyl]acetamide.

Molecular Properties

Compound Name2-benzo[e][1]benzofuran-1-yl-N-[3-(1,3-oxazol-5-yl)phenyl]acetamide
PubChem CID55833347
Molecular FormulaC23H16N2O3
Molecular Weight368.39 g/mol
Exact Mass368.12
IUPAC Name2-benzo[e][1]benzofuran-1-yl-N-[3-(1,3-oxazol-5-yl)phenyl]acetamide
SMILESO=C(Cc1coc2ccc3ccccc3c12)Nc1cccc(-c2cnco2)c1
InChIInChI=1S/C23H16N2O3/c26-22(25-18-6-3-5-16(10-18)21-12-24-14-28-21)11-17-13-27-20-9-8-15-4-1-2-7-19(15)23(17)20/h1-10,12-14H,11H2,(H,25,26)
InChIKeyXNXPWYXHIJELHL-UHFFFAOYSA-N
XLogP5.42
TPSA68.27 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500368.39
LogP ≤ 55.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-benzo[e][1]benzofuran-1-yl-N-[3-(1,3-oxazol-5-yl)phenyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-benzo[e][1]benzofuran-1-yl-N-[3-(1,3-oxazol-5-yl)phenyl]acetamide?
The IUPAC name of 2-benzo[e][1]benzofuran-1-yl-N-[3-(1,3-oxazol-5-yl)phenyl]acetamide (CID 55833347) is 2-benzo[e][1]benzofuran-1-yl-N-[3-(1,3-oxazol-5-yl)phenyl]acetamide.
What is the SMILES notation for 2-benzo[e][1]benzofuran-1-yl-N-[3-(1,3-oxazol-5-yl)phenyl]acetamide?
The canonical SMILES for 2-benzo[e][1]benzofuran-1-yl-N-[3-(1,3-oxazol-5-yl)phenyl]acetamide is O=C(Cc1coc2ccc3ccccc3c12)Nc1cccc(-c2cnco2)c1.
What is the InChIKey of 2-benzo[e][1]benzofuran-1-yl-N-[3-(1,3-oxazol-5-yl)phenyl]acetamide?
The InChIKey is XNXPWYXHIJELHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H16N2O3/c26-22(25-18-6-3-5-16(10-18)21-12-24-14-28-21)11-17-13-27-20-9-8-15-4-1-2-7-19(15)23(17)20/h1-10,12-14H,11H2,(H,25,26).
What are the key properties of 2-benzo[e][1]benzofuran-1-yl-N-[3-(1,3-oxazol-5-yl)phenyl]acetamide?
2-benzo[e][1]benzofuran-1-yl-N-[3-(1,3-oxazol-5-yl)phenyl]acetamide has a molecular weight of 368.39 g/mol, XLogP of 5.42, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzo[e][1]benzofuran-1-yl-N-[3-(1,3-oxazol-5-yl)phenyl]acetamide is sourced from PubChem (CID 55833347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).