3-(ethylamino)-6-(2-methylfuran-3-yl)sulfanyl-1,3-dihydroindol-2-one

C15H16N2O2S — CID 107780694

IUPAC3-(ethylamino)-6-(2-methylfuran-3-yl)sulfanyl-1,3-dihydroindol-2-one
SMILESCCNC1C(=O)Nc2cc(Sc3ccoc3C)ccc21
InChIInChI=1S/C15H16N2O2S/c1-3-16-14-11-5-4-10(8-12(11)17-15(14)18)20-13-6-7-19-9(13)2/h4-8,14,16H,3H2,1-2H3,(H,17,18)
InChIKeyJHQNDJAYGMWDCP-UHFFFAOYSA-N
MW288.37 g/mol
LogP3.34
Rot. Bonds4

About 3-(ethylamino)-6-(2-methylfuran-3-yl)sulfanyl-1,3-dihydroindol-2-one

3-(ethylamino)-6-(2-methylfuran-3-yl)sulfanyl-1,3-dihydroindol-2-one (PubChem CID 107780694) has the molecular formula C15H16N2O2S and a molecular weight of 288.37 g/mol. Its IUPAC name is 3-(ethylamino)-6-(2-methylfuran-3-yl)sulfanyl-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name3-(ethylamino)-6-(2-methylfuran-3-yl)sulfanyl-1,3-dihydroindol-2-one
PubChem CID107780694
Molecular FormulaC15H16N2O2S
Molecular Weight288.37 g/mol
Exact Mass288.09
IUPAC Name3-(ethylamino)-6-(2-methylfuran-3-yl)sulfanyl-1,3-dihydroindol-2-one
SMILESCCNC1C(=O)Nc2cc(Sc3ccoc3C)ccc21
InChIInChI=1S/C15H16N2O2S/c1-3-16-14-11-5-4-10(8-12(11)17-15(14)18)20-13-6-7-19-9(13)2/h4-8,14,16H,3H2,1-2H3,(H,17,18)
InChIKeyJHQNDJAYGMWDCP-UHFFFAOYSA-N
XLogP3.34
TPSA54.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.37
LogP ≤ 53.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(ethylamino)-6-(1,3-thiazol-2-ylsulfanyl)-1,3-dihydroindol-2-one
CID 61218363
3-(ethylamino)-6-(1-methylimidazol-2-yl)sulfanyl-1,3-dihydroindol-2-one
CID 43586901
3-(ethylamino)-6-(2-methylsulfonylethylsulfanyl)-1,3-dihydroindol-2-one
CID 63658122
6-(2-methoxyphenyl)sulfanyl-3-(methylamino)-1,3-dihydroindol-2-one
CID 61290732
6-(2-methylbutylsulfanyl)-3-(propylamino)-1,3-dihydroindol-2-one
CID 107750805
3-(ethylamino)-6-(oxetan-3-yloxy)-1,3-dihydroindol-2-one
CID 102606606
3-(ethylamino)-6-(2-propan-2-yloxyethoxy)-1,3-dihydroindol-2-one
CID 63370564
2-methyl-4-(2-methylfuran-3-yl)sulfanylaniline
CID 107779582
3-(ethylamino)-5,6-difluoro-1,3-dihydroindol-2-one
CID 82235271
5-chloro-3-(ethylamino)-6-methylsulfanyl-1,3-dihydroindol-2-one
CID 79336270
3-(ethylamino)-6-(3-methylpyrazol-1-yl)-1,3-dihydroindol-2-one
CID 63369234
3-(ethylamino)-6-[methyl(2-methylbutyl)amino]-1,3-dihydroindol-2-one
CID 43586810

Frequently Asked Questions

What is the IUPAC name of 3-(ethylamino)-6-(2-methylfuran-3-yl)sulfanyl-1,3-dihydroindol-2-one?
The IUPAC name of 3-(ethylamino)-6-(2-methylfuran-3-yl)sulfanyl-1,3-dihydroindol-2-one (CID 107780694) is 3-(ethylamino)-6-(2-methylfuran-3-yl)sulfanyl-1,3-dihydroindol-2-one.
What is the SMILES notation for 3-(ethylamino)-6-(2-methylfuran-3-yl)sulfanyl-1,3-dihydroindol-2-one?
The canonical SMILES for 3-(ethylamino)-6-(2-methylfuran-3-yl)sulfanyl-1,3-dihydroindol-2-one is CCNC1C(=O)Nc2cc(Sc3ccoc3C)ccc21.
What is the InChIKey of 3-(ethylamino)-6-(2-methylfuran-3-yl)sulfanyl-1,3-dihydroindol-2-one?
The InChIKey is JHQNDJAYGMWDCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2S/c1-3-16-14-11-5-4-10(8-12(11)17-15(14)18)20-13-6-7-19-9(13)2/h4-8,14,16H,3H2,1-2H3,(H,17,18).
What are the key properties of 3-(ethylamino)-6-(2-methylfuran-3-yl)sulfanyl-1,3-dihydroindol-2-one?
3-(ethylamino)-6-(2-methylfuran-3-yl)sulfanyl-1,3-dihydroindol-2-one has a molecular weight of 288.37 g/mol, XLogP of 3.34, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(ethylamino)-6-(2-methylfuran-3-yl)sulfanyl-1,3-dihydroindol-2-one is sourced from PubChem (CID 107780694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).