2-dibenzofuran-2-yloxy-N-[4-(difluoromethylsulfonyl)phenyl]acetamide

C21H15F2NO5S — CID 26898105

IUPAC2-dibenzofuran-2-yloxy-N-[4-(difluoromethylsulfonyl)phenyl]acetamide
SMILESO=C(COc1ccc2oc3ccccc3c2c1)Nc1ccc(S(=O)(=O)C(F)F)cc1
InChIInChI=1S/C21H15F2NO5S/c22-21(23)30(26,27)15-8-5-13(6-9-15)24-20(25)12-28-14-7-10-19-17(11-14)16-3-1-2-4-18(16)29-19/h1-11,21H,12H2,(H,24,25)
InChIKeyNMRPFUMXUCUKFS-UHFFFAOYSA-N
MW431.42 g/mol
LogP4.60
Rot. Bonds6

About 2-dibenzofuran-2-yloxy-N-[4-(difluoromethylsulfonyl)phenyl]acetamide

2-dibenzofuran-2-yloxy-N-[4-(difluoromethylsulfonyl)phenyl]acetamide (PubChem CID 26898105) has the molecular formula C21H15F2NO5S and a molecular weight of 431.42 g/mol. Its IUPAC name is 2-dibenzofuran-2-yloxy-N-[4-(difluoromethylsulfonyl)phenyl]acetamide.

Molecular Properties

Compound Name2-dibenzofuran-2-yloxy-N-[4-(difluoromethylsulfonyl)phenyl]acetamide
PubChem CID26898105
Molecular FormulaC21H15F2NO5S
Molecular Weight431.42 g/mol
Exact Mass431.06
IUPAC Name2-dibenzofuran-2-yloxy-N-[4-(difluoromethylsulfonyl)phenyl]acetamide
SMILESO=C(COc1ccc2oc3ccccc3c2c1)Nc1ccc(S(=O)(=O)C(F)F)cc1
InChIInChI=1S/C21H15F2NO5S/c22-21(23)30(26,27)15-8-5-13(6-9-15)24-20(25)12-28-14-7-10-19-17(11-14)16-3-1-2-4-18(16)29-19/h1-11,21H,12H2,(H,24,25)
InChIKeyNMRPFUMXUCUKFS-UHFFFAOYSA-N
XLogP4.60
TPSA85.61 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500431.42
LogP ≤ 54.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-dibenzofuran-2-yloxy-N-(4-methylsulfonylphenyl)acetamide
CID 9455805
2-(4-chlorophenoxy)-N-[4-(difluoromethylsulfonyl)phenyl]acetamide
CID 8503445
2-dibenzofuran-2-yloxy-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide
CID 26645002
methyl 3-[2-[4-(difluoromethylsulfonyl)anilino]-2-oxoethoxy]benzoate
CID 55468453
2-(4-acetylphenoxy)-N-dibenzofuran-2-ylacetamide
CID 2635783
N-dibenzofuran-2-yl-2-(2-oxochromen-7-yl)oxyacetamide
CID 8536224
N-dibenzofuran-2-yl-2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]acetamide
CID 24652342
N-dibenzofuran-3-yl-2-(4-propan-2-ylphenoxy)acetamide
CID 3150701
2-dibenzofuran-2-yloxy-N-(1-phenylethyl)acetamide
CID 3648980
N-[2-(2-amino-2-oxoethyl)sulfanylphenyl]-2-dibenzofuran-2-yloxyacetamide
CID 46671265
N-(4-methylsulfonylphenyl)-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide
CID 8840330
2-[2-[4-(difluoromethylsulfonyl)anilino]-2-oxoethoxy]acetic acid
CID 60708142

Frequently Asked Questions

What is the IUPAC name of 2-dibenzofuran-2-yloxy-N-[4-(difluoromethylsulfonyl)phenyl]acetamide?
The IUPAC name of 2-dibenzofuran-2-yloxy-N-[4-(difluoromethylsulfonyl)phenyl]acetamide (CID 26898105) is 2-dibenzofuran-2-yloxy-N-[4-(difluoromethylsulfonyl)phenyl]acetamide.
What is the SMILES notation for 2-dibenzofuran-2-yloxy-N-[4-(difluoromethylsulfonyl)phenyl]acetamide?
The canonical SMILES for 2-dibenzofuran-2-yloxy-N-[4-(difluoromethylsulfonyl)phenyl]acetamide is O=C(COc1ccc2oc3ccccc3c2c1)Nc1ccc(S(=O)(=O)C(F)F)cc1.
What is the InChIKey of 2-dibenzofuran-2-yloxy-N-[4-(difluoromethylsulfonyl)phenyl]acetamide?
The InChIKey is NMRPFUMXUCUKFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H15F2NO5S/c22-21(23)30(26,27)15-8-5-13(6-9-15)24-20(25)12-28-14-7-10-19-17(11-14)16-3-1-2-4-18(16)29-19/h1-11,21H,12H2,(H,24,25).
What are the key properties of 2-dibenzofuran-2-yloxy-N-[4-(difluoromethylsulfonyl)phenyl]acetamide?
2-dibenzofuran-2-yloxy-N-[4-(difluoromethylsulfonyl)phenyl]acetamide has a molecular weight of 431.42 g/mol, XLogP of 4.60, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-dibenzofuran-2-yloxy-N-[4-(difluoromethylsulfonyl)phenyl]acetamide is sourced from PubChem (CID 26898105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).