2-[4-(2,3-dihydroindol-1-ylsulfonyl)phenoxy]-N-phenylacetamide

C22H20N2O4S — CID 4305979

IUPAC2-[4-(2,3-dihydroindol-1-ylsulfonyl)phenoxy]-N-phenylacetamide
SMILESO=C(COc1ccc(S(=O)(=O)N2CCc3ccccc32)cc1)Nc1ccccc1
InChIInChI=1S/C22H20N2O4S/c25-22(23-18-7-2-1-3-8-18)16-28-19-10-12-20(13-11-19)29(26,27)24-15-14-17-6-4-5-9-21(17)24/h1-13H,14-16H2,(H,23,25)
InChIKeyZKDPERKUQVDWHC-UHFFFAOYSA-N
MW408.48 g/mol
LogP3.46
Rot. Bonds6

About 2-[4-(2,3-dihydroindol-1-ylsulfonyl)phenoxy]-N-phenylacetamide

2-[4-(2,3-dihydroindol-1-ylsulfonyl)phenoxy]-N-phenylacetamide (PubChem CID 4305979) has the molecular formula C22H20N2O4S and a molecular weight of 408.48 g/mol. Its IUPAC name is 2-[4-(2,3-dihydroindol-1-ylsulfonyl)phenoxy]-N-phenylacetamide.

Molecular Properties

Compound Name2-[4-(2,3-dihydroindol-1-ylsulfonyl)phenoxy]-N-phenylacetamide
PubChem CID4305979
Molecular FormulaC22H20N2O4S
Molecular Weight408.48 g/mol
Exact Mass408.11
IUPAC Name2-[4-(2,3-dihydroindol-1-ylsulfonyl)phenoxy]-N-phenylacetamide
SMILESO=C(COc1ccc(S(=O)(=O)N2CCc3ccccc32)cc1)Nc1ccccc1
InChIInChI=1S/C22H20N2O4S/c25-22(23-18-7-2-1-3-8-18)16-28-19-10-12-20(13-11-19)29(26,27)24-15-14-17-6-4-5-9-21(17)24/h1-13H,14-16H2,(H,23,25)
InChIKeyZKDPERKUQVDWHC-UHFFFAOYSA-N
XLogP3.46
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.48
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-tert-butylphenoxy)-N-[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]acetamide
CID 1013636
N-(4-acetamidophenyl)-2-[4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenoxy]acetamide
CID 126396063
2-[4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenoxy]-N-(4-iodophenyl)acetamide
CID 126392373
2-[4-(2,3-dihydroindol-1-ylsulfonyl)phenoxy]-N-(2,6-dimethylphenyl)acetamide
CID 3953512
N-(3-bromophenyl)-2-[4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenoxy]acetamide
CID 126394713
2-[4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenoxy]-N-(3,5-dimethylphenyl)acetamide
CID 126397249
1-[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]-3-phenylurea
CID 1150802
2-[4-(2,3-dihydroindol-1-ylsulfonyl)phenoxy]-N-pentylacetamide
CID 5114863
2-(2,4-dibromophenoxy)-N-[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]acetamide
CID 1013039
2-(4-bromo-2-methylphenoxy)-N-[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]acetamide
CID 3482740
(2-anilino-2-oxoethyl) 3-(2,3-dihydroindol-1-ylsulfonyl)benzoate
CID 2551453
N-[1-(benzenesulfonyl)-3,4-dihydro-2H-quinolin-7-yl]-2-phenoxyacetamide
CID 18565098

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2,3-dihydroindol-1-ylsulfonyl)phenoxy]-N-phenylacetamide?
The IUPAC name of 2-[4-(2,3-dihydroindol-1-ylsulfonyl)phenoxy]-N-phenylacetamide (CID 4305979) is 2-[4-(2,3-dihydroindol-1-ylsulfonyl)phenoxy]-N-phenylacetamide.
What is the SMILES notation for 2-[4-(2,3-dihydroindol-1-ylsulfonyl)phenoxy]-N-phenylacetamide?
The canonical SMILES for 2-[4-(2,3-dihydroindol-1-ylsulfonyl)phenoxy]-N-phenylacetamide is O=C(COc1ccc(S(=O)(=O)N2CCc3ccccc32)cc1)Nc1ccccc1.
What is the InChIKey of 2-[4-(2,3-dihydroindol-1-ylsulfonyl)phenoxy]-N-phenylacetamide?
The InChIKey is ZKDPERKUQVDWHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N2O4S/c25-22(23-18-7-2-1-3-8-18)16-28-19-10-12-20(13-11-19)29(26,27)24-15-14-17-6-4-5-9-21(17)24/h1-13H,14-16H2,(H,23,25).
What are the key properties of 2-[4-(2,3-dihydroindol-1-ylsulfonyl)phenoxy]-N-phenylacetamide?
2-[4-(2,3-dihydroindol-1-ylsulfonyl)phenoxy]-N-phenylacetamide has a molecular weight of 408.48 g/mol, XLogP of 3.46, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2,3-dihydroindol-1-ylsulfonyl)phenoxy]-N-phenylacetamide is sourced from PubChem (CID 4305979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).