8-(2,3-dihydroindol-1-ylsulfonyl)quinoline

C17H14N2O2S — CID 659903

IUPAC8-(2,3-dihydroindol-1-ylsulfonyl)quinoline
SMILESO=S(=O)(c1cccc2cccnc12)N1CCc2ccccc21
InChIInChI=1S/C17H14N2O2S/c20-22(21,19-12-10-13-5-1-2-8-15(13)19)16-9-3-6-14-7-4-11-18-17(14)16/h1-9,11H,10,12H2
InChIKeyJGTVXBOVQGPYDP-UHFFFAOYSA-N
MW310.38 g/mol
LogP2.99
Rot. Bonds2

About 8-(2,3-dihydroindol-1-ylsulfonyl)quinoline

8-(2,3-dihydroindol-1-ylsulfonyl)quinoline (PubChem CID 659903) has the molecular formula C17H14N2O2S and a molecular weight of 310.38 g/mol. Its IUPAC name is 8-(2,3-dihydroindol-1-ylsulfonyl)quinoline.

Molecular Properties

Compound Name8-(2,3-dihydroindol-1-ylsulfonyl)quinoline
PubChem CID659903
Molecular FormulaC17H14N2O2S
Molecular Weight310.38 g/mol
Exact Mass310.08
IUPAC Name8-(2,3-dihydroindol-1-ylsulfonyl)quinoline
SMILESO=S(=O)(c1cccc2cccnc12)N1CCc2ccccc21
InChIInChI=1S/C17H14N2O2S/c20-22(21,19-12-10-13-5-1-2-8-15(13)19)16-9-3-6-14-7-4-11-18-17(14)16/h1-9,11H,10,12H2
InChIKeyJGTVXBOVQGPYDP-UHFFFAOYSA-N
XLogP2.99
TPSA50.27 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.38
LogP ≤ 52.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-(2,3-dihydroindol-1-ylsulfonyl)quinoline?
The IUPAC name of 8-(2,3-dihydroindol-1-ylsulfonyl)quinoline (CID 659903) is 8-(2,3-dihydroindol-1-ylsulfonyl)quinoline.
What is the SMILES notation for 8-(2,3-dihydroindol-1-ylsulfonyl)quinoline?
The canonical SMILES for 8-(2,3-dihydroindol-1-ylsulfonyl)quinoline is O=S(=O)(c1cccc2cccnc12)N1CCc2ccccc21.
What is the InChIKey of 8-(2,3-dihydroindol-1-ylsulfonyl)quinoline?
The InChIKey is JGTVXBOVQGPYDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2O2S/c20-22(21,19-12-10-13-5-1-2-8-15(13)19)16-9-3-6-14-7-4-11-18-17(14)16/h1-9,11H,10,12H2.
What are the key properties of 8-(2,3-dihydroindol-1-ylsulfonyl)quinoline?
8-(2,3-dihydroindol-1-ylsulfonyl)quinoline has a molecular weight of 310.38 g/mol, XLogP of 2.99, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(2,3-dihydroindol-1-ylsulfonyl)quinoline is sourced from PubChem (CID 659903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).