1-naphthalen-2-ylsulfonyl-2H-indol-3-one

C18H13NO3S — CID 172633436

IUPAC1-naphthalen-2-ylsulfonyl-2H-indol-3-one
SMILESO=C1CN(S(=O)(=O)c2ccc3ccccc3c2)c2ccccc21
InChIInChI=1S/C18H13NO3S/c20-18-12-19(17-8-4-3-7-16(17)18)23(21,22)15-10-9-13-5-1-2-6-14(13)11-15/h1-11H,12H2
InChIKeyIISYDWFIYCLCLX-UHFFFAOYSA-N
MW323.37 g/mol
LogP3.23
Rot. Bonds2

About 1-naphthalen-2-ylsulfonyl-2H-indol-3-one

1-naphthalen-2-ylsulfonyl-2H-indol-3-one (PubChem CID 172633436) has the molecular formula C18H13NO3S and a molecular weight of 323.37 g/mol. Its IUPAC name is 1-naphthalen-2-ylsulfonyl-2H-indol-3-one.

Molecular Properties

Compound Name1-naphthalen-2-ylsulfonyl-2H-indol-3-one
PubChem CID172633436
Molecular FormulaC18H13NO3S
Molecular Weight323.37 g/mol
Exact Mass323.06
IUPAC Name1-naphthalen-2-ylsulfonyl-2H-indol-3-one
SMILESO=C1CN(S(=O)(=O)c2ccc3ccccc3c2)c2ccccc21
InChIInChI=1S/C18H13NO3S/c20-18-12-19(17-8-4-3-7-16(17)18)23(21,22)15-10-9-13-5-1-2-6-14(13)11-15/h1-11H,12H2
InChIKeyIISYDWFIYCLCLX-UHFFFAOYSA-N
XLogP3.23
TPSA54.45 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.37
LogP ≤ 53.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-chlorophenyl)sulfonyl-2H-indol-3-one
CID 172633432
1-(4-bromophenyl)sulfonyl-2H-indol-3-one
CID 102600373
5-[3,5-bis(trifluoromethyl)phenyl]sulfonyl-6H-benzo[d][1]benzazepin-7-one
CID 86644585
1-(benzenesulfonyl)-5-methoxy-2H-indol-3-one
CID 595498
1-naphthalen-2-ylsulfonylpyrrolidine
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2-methyl-1-naphthalen-2-ylsulfonyl-4,5-dihydroimidazole
CID 16761146
1-(1,3-benzodioxol-5-ylsulfonyl)-2,3-dihydroquinolin-4-one
CID 110424789
(2S)-1-naphthalen-2-ylsulfonyl-2,3-dihydroindole-2-carboxylic acid
CID 164640962
2-naphthalen-2-ylsulfonyl-3,4-dihydro-1H-isoquinoline
CID 808079
1-methyl-4-naphthalen-2-ylsulfonylpiperazine
CID 872090
4-cyclopropylidene-1-naphthalen-2-ylsulfonylpiperidine
CID 121187246
CID 88530425
CID 88530425

Frequently Asked Questions

What is the IUPAC name of 1-naphthalen-2-ylsulfonyl-2H-indol-3-one?
The IUPAC name of 1-naphthalen-2-ylsulfonyl-2H-indol-3-one (CID 172633436) is 1-naphthalen-2-ylsulfonyl-2H-indol-3-one.
What is the SMILES notation for 1-naphthalen-2-ylsulfonyl-2H-indol-3-one?
The canonical SMILES for 1-naphthalen-2-ylsulfonyl-2H-indol-3-one is O=C1CN(S(=O)(=O)c2ccc3ccccc3c2)c2ccccc21.
What is the InChIKey of 1-naphthalen-2-ylsulfonyl-2H-indol-3-one?
The InChIKey is IISYDWFIYCLCLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13NO3S/c20-18-12-19(17-8-4-3-7-16(17)18)23(21,22)15-10-9-13-5-1-2-6-14(13)11-15/h1-11H,12H2.
What are the key properties of 1-naphthalen-2-ylsulfonyl-2H-indol-3-one?
1-naphthalen-2-ylsulfonyl-2H-indol-3-one has a molecular weight of 323.37 g/mol, XLogP of 3.23, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-naphthalen-2-ylsulfonyl-2H-indol-3-one is sourced from PubChem (CID 172633436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).