1-(2,3-dihydro-1H-inden-5-ylsulfonyl)-2,3-dihydroindole

C17H17NO2S — CID 4806110

IUPAC1-(2,3-dihydro-1H-inden-5-ylsulfonyl)-2,3-dihydroindole
SMILESO=S(=O)(c1ccc2c(c1)CCC2)N1CCc2ccccc21
InChIInChI=1S/C17H17NO2S/c19-21(20,16-9-8-13-5-3-6-15(13)12-16)18-11-10-14-4-1-2-7-17(14)18/h1-2,4,7-9,12H,3,5-6,10-11H2
InChIKeyBYIFWSLLOBMFJE-UHFFFAOYSA-N
MW299.39 g/mol
LogP2.93
Rot. Bonds2

About 1-(2,3-dihydro-1H-inden-5-ylsulfonyl)-2,3-dihydroindole

1-(2,3-dihydro-1H-inden-5-ylsulfonyl)-2,3-dihydroindole (PubChem CID 4806110) has the molecular formula C17H17NO2S and a molecular weight of 299.39 g/mol. Its IUPAC name is 1-(2,3-dihydro-1H-inden-5-ylsulfonyl)-2,3-dihydroindole.

Molecular Properties

Compound Name1-(2,3-dihydro-1H-inden-5-ylsulfonyl)-2,3-dihydroindole
PubChem CID4806110
Molecular FormulaC17H17NO2S
Molecular Weight299.39 g/mol
Exact Mass299.10
IUPAC Name1-(2,3-dihydro-1H-inden-5-ylsulfonyl)-2,3-dihydroindole
SMILESO=S(=O)(c1ccc2c(c1)CCC2)N1CCc2ccccc21
InChIInChI=1S/C17H17NO2S/c19-21(20,16-9-8-13-5-3-6-15(13)12-16)18-11-10-14-4-1-2-7-17(14)18/h1-2,4,7-9,12H,3,5-6,10-11H2
InChIKeyBYIFWSLLOBMFJE-UHFFFAOYSA-N
XLogP2.93
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.39
LogP ≤ 52.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

6-(2,3-dihydroindol-1-ylsulfonyl)-1,2,3,4-tetrahydroquinoline
CID 22692421
1-(3-pyrrolidin-1-ylsulfonylphenyl)sulfonyl-2,3-dihydroindole
CID 43811959
1-(2,3-dihydro-1-benzofuran-5-ylsulfonyl)-2,3-dihydroindole
CID 46807431
1-(3-methylphenyl)sulfonyl-2,3-dihydroindole
CID 5010201
1-[7-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-3,4-dihydro-1H-isoquinolin-2-yl]-2-hydroxyethanone
CID 70758696
1-(3-methylsulfonylphenyl)sulfonyl-2,3-dihydroindole
CID 6462869
1-[4-[4-(2,3-dihydroindol-1-ylsulfonyl)phenoxy]phenyl]sulfonyl-2,3-dihydroindole
CID 91670097
3-(2,3-dihydroindol-1-ylsulfonyl)benzoate
CID 7062520
1-(3-nitrophenyl)sulfonyl-2,3-dihydroindole
CID 2952438
1-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)-3,4-dihydro-2H-quinolin-4-ol
CID 110636873
4-(2,3-dihydroindol-1-ylsulfonyl)benzoic acid
CID 856543
3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzenesulfonamide
CID 31064364

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydro-1H-inden-5-ylsulfonyl)-2,3-dihydroindole?
The IUPAC name of 1-(2,3-dihydro-1H-inden-5-ylsulfonyl)-2,3-dihydroindole (CID 4806110) is 1-(2,3-dihydro-1H-inden-5-ylsulfonyl)-2,3-dihydroindole.
What is the SMILES notation for 1-(2,3-dihydro-1H-inden-5-ylsulfonyl)-2,3-dihydroindole?
The canonical SMILES for 1-(2,3-dihydro-1H-inden-5-ylsulfonyl)-2,3-dihydroindole is O=S(=O)(c1ccc2c(c1)CCC2)N1CCc2ccccc21.
What is the InChIKey of 1-(2,3-dihydro-1H-inden-5-ylsulfonyl)-2,3-dihydroindole?
The InChIKey is BYIFWSLLOBMFJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17NO2S/c19-21(20,16-9-8-13-5-3-6-15(13)12-16)18-11-10-14-4-1-2-7-17(14)18/h1-2,4,7-9,12H,3,5-6,10-11H2.
What are the key properties of 1-(2,3-dihydro-1H-inden-5-ylsulfonyl)-2,3-dihydroindole?
1-(2,3-dihydro-1H-inden-5-ylsulfonyl)-2,3-dihydroindole has a molecular weight of 299.39 g/mol, XLogP of 2.93, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydro-1H-inden-5-ylsulfonyl)-2,3-dihydroindole is sourced from PubChem (CID 4806110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).