N-(3-chlorophenyl)-2-(5-fluoro-1-benzofuran-3-yl)acetamide

C16H11ClFNO2 — CID 18860141

IUPACN-(3-chlorophenyl)-2-(5-fluoro-1-benzofuran-3-yl)acetamide
SMILESO=C(Cc1coc2ccc(F)cc12)Nc1cccc(Cl)c1
InChIInChI=1S/C16H11ClFNO2/c17-11-2-1-3-13(7-11)19-16(20)6-10-9-21-15-5-4-12(18)8-14(10)15/h1-5,7-9H,6H2,(H,19,20)
InChIKeyDMXRLUBDGIJCHT-UHFFFAOYSA-N
MW303.72 g/mol
LogP4.41
Rot. Bonds3

About N-(3-chlorophenyl)-2-(5-fluoro-1-benzofuran-3-yl)acetamide

N-(3-chlorophenyl)-2-(5-fluoro-1-benzofuran-3-yl)acetamide (PubChem CID 18860141) has the molecular formula C16H11ClFNO2 and a molecular weight of 303.72 g/mol. Its IUPAC name is N-(3-chlorophenyl)-2-(5-fluoro-1-benzofuran-3-yl)acetamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-2-(5-fluoro-1-benzofuran-3-yl)acetamide
PubChem CID18860141
Molecular FormulaC16H11ClFNO2
Molecular Weight303.72 g/mol
Exact Mass303.05
IUPAC NameN-(3-chlorophenyl)-2-(5-fluoro-1-benzofuran-3-yl)acetamide
SMILESO=C(Cc1coc2ccc(F)cc12)Nc1cccc(Cl)c1
InChIInChI=1S/C16H11ClFNO2/c17-11-2-1-3-13(7-11)19-16(20)6-10-9-21-15-5-4-12(18)8-14(10)15/h1-5,7-9H,6H2,(H,19,20)
InChIKeyDMXRLUBDGIJCHT-UHFFFAOYSA-N
XLogP4.41
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.72
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(1-benzofuran-3-yl)-N-(3-fluorophenyl)acetamide
CID 110862760
2-(5-chloro-1-benzofuran-3-yl)-N-(3,4-dimethylphenyl)acetamide
CID 18860311
2-(5-fluoro-1-benzofuran-3-yl)-N-(furan-2-ylmethyl)acetamide
CID 110488713
N-(2,5-dimethylphenyl)-2-(5-fluoro-1-benzofuran-3-yl)acetamide
CID 18860149
N-(3-acetylphenyl)-2-(5-methyl-1-benzofuran-3-yl)acetamide
CID 18872372
N-(2-benzoyl-1-benzofuran-3-yl)-2-(5-fluoro-1-benzofuran-3-yl)acetamide
CID 18860659
3-[[2-(5-fluoro-1-benzofuran-3-yl)acetyl]amino]propanoic acid
CID 110488680
2-(5,6-dimethyl-1-benzofuran-3-yl)-N-(4-fluorophenyl)acetamide
CID 7733151
N-(3-acetylphenyl)-2-(5-chloro-6-methyl-1-benzofuran-3-yl)acetamide
CID 2990500
N-(3-acetylphenyl)-2-(5,6-dimethyl-1-benzofuran-3-yl)acetamide
CID 7770634
N-(2-chloro-4-fluorophenyl)-2-(5,6-dimethyl-1-benzofuran-3-yl)acetamide
CID 26364046
N-[2-(4-bromobenzoyl)-1-benzofuran-3-yl]-2-(5-fluoro-1-benzofuran-3-yl)acetamide
CID 18860663

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-2-(5-fluoro-1-benzofuran-3-yl)acetamide?
The IUPAC name of N-(3-chlorophenyl)-2-(5-fluoro-1-benzofuran-3-yl)acetamide (CID 18860141) is N-(3-chlorophenyl)-2-(5-fluoro-1-benzofuran-3-yl)acetamide.
What is the SMILES notation for N-(3-chlorophenyl)-2-(5-fluoro-1-benzofuran-3-yl)acetamide?
The canonical SMILES for N-(3-chlorophenyl)-2-(5-fluoro-1-benzofuran-3-yl)acetamide is O=C(Cc1coc2ccc(F)cc12)Nc1cccc(Cl)c1.
What is the InChIKey of N-(3-chlorophenyl)-2-(5-fluoro-1-benzofuran-3-yl)acetamide?
The InChIKey is DMXRLUBDGIJCHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11ClFNO2/c17-11-2-1-3-13(7-11)19-16(20)6-10-9-21-15-5-4-12(18)8-14(10)15/h1-5,7-9H,6H2,(H,19,20).
What are the key properties of N-(3-chlorophenyl)-2-(5-fluoro-1-benzofuran-3-yl)acetamide?
N-(3-chlorophenyl)-2-(5-fluoro-1-benzofuran-3-yl)acetamide has a molecular weight of 303.72 g/mol, XLogP of 4.41, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-2-(5-fluoro-1-benzofuran-3-yl)acetamide is sourced from PubChem (CID 18860141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).