2-benzo[e][1]benzofuran-1-yl-N-(2-chlorophenyl)acetamide

C20H14ClNO2 — CID 829773

IUPAC2-benzo[e][1]benzofuran-1-yl-N-(2-chlorophenyl)acetamide
SMILESO=C(Cc1coc2ccc3ccccc3c12)Nc1ccccc1Cl
InChIInChI=1S/C20H14ClNO2/c21-16-7-3-4-8-17(16)22-19(23)11-14-12-24-18-10-9-13-5-1-2-6-15(13)20(14)18/h1-10,12H,11H2,(H,22,23)
InChIKeyGDNZYNGDPMKXLB-UHFFFAOYSA-N
MW335.79 g/mol
LogP5.42
Rot. Bonds3

About 2-benzo[e][1]benzofuran-1-yl-N-(2-chlorophenyl)acetamide

2-benzo[e][1]benzofuran-1-yl-N-(2-chlorophenyl)acetamide (PubChem CID 829773) has the molecular formula C20H14ClNO2 and a molecular weight of 335.79 g/mol. Its IUPAC name is 2-benzo[e][1]benzofuran-1-yl-N-(2-chlorophenyl)acetamide.

Molecular Properties

Compound Name2-benzo[e][1]benzofuran-1-yl-N-(2-chlorophenyl)acetamide
PubChem CID829773
Molecular FormulaC20H14ClNO2
Molecular Weight335.79 g/mol
Exact Mass335.07
IUPAC Name2-benzo[e][1]benzofuran-1-yl-N-(2-chlorophenyl)acetamide
SMILESO=C(Cc1coc2ccc3ccccc3c12)Nc1ccccc1Cl
InChIInChI=1S/C20H14ClNO2/c21-16-7-3-4-8-17(16)22-19(23)11-14-12-24-18-10-9-13-5-1-2-6-15(13)20(14)18/h1-10,12H,11H2,(H,22,23)
InChIKeyGDNZYNGDPMKXLB-UHFFFAOYSA-N
XLogP5.42
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500335.79
LogP ≤ 55.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-benzo[e][1]benzofuran-1-yl-N-(2-phenylsulfanylphenyl)acetamide
CID 4728261
2-benzo[e][1]benzofuran-1-yl-N-(2,4-difluorophenyl)acetamide
CID 4799876
2-benzo[e][1]benzofuran-1-yl-N-piperidin-1-ylacetamide
CID 9271571
2-(5-chloro-1-benzofuran-3-yl)-N-naphthalen-1-ylacetamide
CID 18860319
N-(2-chlorophenyl)-2-(6-methyl-1-benzofuran-3-yl)acetamide
CID 2600753
2-benzo[e][1]benzofuran-1-yl-N-(4-piperidin-1-ylphenyl)acetamide
CID 7922400
N-[4-(azepan-1-ylsulfonyl)phenyl]-2-benzo[e][1]benzofuran-1-ylacetamide
CID 18860774
N-[4-acetamido-2-(trifluoromethyl)phenyl]-2-benzo[e][1]benzofuran-1-ylacetamide
CID 16605099
N'-(2-benzo[e][1]benzofuran-1-ylacetyl)quinoline-2-carbohydrazide
CID 29266482
4-[(2-benzo[e][1]benzofuran-1-ylacetyl)amino]-N-(2-methoxyphenyl)benzamide
CID 29292226
2-benzo[e][1]benzofuran-1-yl-N-[4-(difluoromethylsulfanyl)phenyl]acetamide
CID 4728274
2-benzo[e][1]benzofuran-1-yl-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
CID 1281578

Frequently Asked Questions

What is the IUPAC name of 2-benzo[e][1]benzofuran-1-yl-N-(2-chlorophenyl)acetamide?
The IUPAC name of 2-benzo[e][1]benzofuran-1-yl-N-(2-chlorophenyl)acetamide (CID 829773) is 2-benzo[e][1]benzofuran-1-yl-N-(2-chlorophenyl)acetamide.
What is the SMILES notation for 2-benzo[e][1]benzofuran-1-yl-N-(2-chlorophenyl)acetamide?
The canonical SMILES for 2-benzo[e][1]benzofuran-1-yl-N-(2-chlorophenyl)acetamide is O=C(Cc1coc2ccc3ccccc3c12)Nc1ccccc1Cl.
What is the InChIKey of 2-benzo[e][1]benzofuran-1-yl-N-(2-chlorophenyl)acetamide?
The InChIKey is GDNZYNGDPMKXLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14ClNO2/c21-16-7-3-4-8-17(16)22-19(23)11-14-12-24-18-10-9-13-5-1-2-6-15(13)20(14)18/h1-10,12H,11H2,(H,22,23).
What are the key properties of 2-benzo[e][1]benzofuran-1-yl-N-(2-chlorophenyl)acetamide?
2-benzo[e][1]benzofuran-1-yl-N-(2-chlorophenyl)acetamide has a molecular weight of 335.79 g/mol, XLogP of 5.42, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzo[e][1]benzofuran-1-yl-N-(2-chlorophenyl)acetamide is sourced from PubChem (CID 829773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).