2-(4-chlorophenyl)-N-(2,3-dihydro-1-benzofuran-3-yl)acetamide

C16H14ClNO2 — CID 110751602

IUPAC2-(4-chlorophenyl)-N-(2,3-dihydro-1-benzofuran-3-yl)acetamide
SMILESO=C(Cc1ccc(Cl)cc1)NC1COc2ccccc21
InChIInChI=1S/C16H14ClNO2/c17-12-7-5-11(6-8-12)9-16(19)18-14-10-20-15-4-2-1-3-13(14)15/h1-8,14H,9-10H2,(H,18,19)
InChIKeyJBEZCTZZDKMSQW-UHFFFAOYSA-N
MW287.75 g/mol
LogP3.13
Rot. Bonds3

About 2-(4-chlorophenyl)-N-(2,3-dihydro-1-benzofuran-3-yl)acetamide

2-(4-chlorophenyl)-N-(2,3-dihydro-1-benzofuran-3-yl)acetamide (PubChem CID 110751602) has the molecular formula C16H14ClNO2 and a molecular weight of 287.75 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-N-(2,3-dihydro-1-benzofuran-3-yl)acetamide.

Molecular Properties

Compound Name2-(4-chlorophenyl)-N-(2,3-dihydro-1-benzofuran-3-yl)acetamide
PubChem CID110751602
Molecular FormulaC16H14ClNO2
Molecular Weight287.75 g/mol
Exact Mass287.07
IUPAC Name2-(4-chlorophenyl)-N-(2,3-dihydro-1-benzofuran-3-yl)acetamide
SMILESO=C(Cc1ccc(Cl)cc1)NC1COc2ccccc21
InChIInChI=1S/C16H14ClNO2/c17-12-7-5-11(6-8-12)9-16(19)18-14-10-20-15-4-2-1-3-13(14)15/h1-8,14H,9-10H2,(H,18,19)
InChIKeyJBEZCTZZDKMSQW-UHFFFAOYSA-N
XLogP3.13
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.75
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-N-(2,3-dihydro-1-benzofuran-3-yl)acetamide?
The IUPAC name of 2-(4-chlorophenyl)-N-(2,3-dihydro-1-benzofuran-3-yl)acetamide (CID 110751602) is 2-(4-chlorophenyl)-N-(2,3-dihydro-1-benzofuran-3-yl)acetamide.
What is the SMILES notation for 2-(4-chlorophenyl)-N-(2,3-dihydro-1-benzofuran-3-yl)acetamide?
The canonical SMILES for 2-(4-chlorophenyl)-N-(2,3-dihydro-1-benzofuran-3-yl)acetamide is O=C(Cc1ccc(Cl)cc1)NC1COc2ccccc21.
What is the InChIKey of 2-(4-chlorophenyl)-N-(2,3-dihydro-1-benzofuran-3-yl)acetamide?
The InChIKey is JBEZCTZZDKMSQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14ClNO2/c17-12-7-5-11(6-8-12)9-16(19)18-14-10-20-15-4-2-1-3-13(14)15/h1-8,14H,9-10H2,(H,18,19).
What are the key properties of 2-(4-chlorophenyl)-N-(2,3-dihydro-1-benzofuran-3-yl)acetamide?
2-(4-chlorophenyl)-N-(2,3-dihydro-1-benzofuran-3-yl)acetamide has a molecular weight of 287.75 g/mol, XLogP of 3.13, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-N-(2,3-dihydro-1-benzofuran-3-yl)acetamide is sourced from PubChem (CID 110751602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).