2-(2-oxo-1H-quinolin-3-yl)-1H-indole-6-sulfonamide

C17H13N3O3S — CID 142239743

IUPAC2-(2-oxo-1H-quinolin-3-yl)-1H-indole-6-sulfonamide
SMILESNS(=O)(=O)c1ccc2cc(-c3cc4ccccc4[nH]c3=O)[nH]c2c1
InChIInChI=1S/C17H13N3O3S/c18-24(22,23)12-6-5-11-8-16(19-15(11)9-12)13-7-10-3-1-2-4-14(10)20-17(13)21/h1-9,19H,(H,20,21)(H2,18,22,23)
InChIKeyXAJNOTRUYBYRQG-UHFFFAOYSA-N
MW339.38 g/mol
LogP2.32
Rot. Bonds2

About 2-(2-oxo-1H-quinolin-3-yl)-1H-indole-6-sulfonamide

2-(2-oxo-1H-quinolin-3-yl)-1H-indole-6-sulfonamide (PubChem CID 142239743) has the molecular formula C17H13N3O3S and a molecular weight of 339.38 g/mol. Its IUPAC name is 2-(2-oxo-1H-quinolin-3-yl)-1H-indole-6-sulfonamide.

Molecular Properties

Compound Name2-(2-oxo-1H-quinolin-3-yl)-1H-indole-6-sulfonamide
PubChem CID142239743
Molecular FormulaC17H13N3O3S
Molecular Weight339.38 g/mol
Exact Mass339.07
IUPAC Name2-(2-oxo-1H-quinolin-3-yl)-1H-indole-6-sulfonamide
SMILESNS(=O)(=O)c1ccc2cc(-c3cc4ccccc4[nH]c3=O)[nH]c2c1
InChIInChI=1S/C17H13N3O3S/c18-24(22,23)12-6-5-11-8-16(19-15(11)9-12)13-7-10-3-1-2-4-14(10)20-17(13)21/h1-9,19H,(H,20,21)(H2,18,22,23)
InChIKeyXAJNOTRUYBYRQG-UHFFFAOYSA-N
XLogP2.32
TPSA108.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.38
LogP ≤ 52.32
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-(5-amino-1H-indol-2-yl)-1H-quinolin-2-one
CID 22668309
3-(1H-indol-2-yl)-1H-indazole-6-sulfonamide
CID 135506581
3-(5-imidazolidin-1-ylsulfonyl-1H-indol-2-yl)-1H-quinolin-2-one
CID 10178750
[4-(2-oxo-1H-quinolin-3-yl)phenyl] sulfamate
CID 11989630
3-[5-(hydroxymethyl)-1H-indol-2-yl]-1H-quinolin-2-one
CID 174398264
2-(1H-indol-2-yl)phenol;sulfuric acid
CID 155109187
3-[5-(methylaminomethyl)-1H-indol-2-yl]-1H-quinolin-2-one
CID 142218394
2-[2-(4-methylsulfonylphenyl)phenyl]-1H-indole
CID 70342342
2-[[2-(2-oxo-1H-quinolin-3-yl)-1H-indol-5-yl]oxy]acetonitrile
CID 22668287
N-[2-(1H-indol-2-yl)phenyl]naphthalene-2-sulfonamide
CID 3532370
3-[5-(azetidin-1-ylmethyl)-1H-indol-2-yl]-1H-quinolin-2-one
CID 10131514
6-sulfamoyl-1H-indole-2-carboxylic acid
CID 66925507

Frequently Asked Questions

What is the IUPAC name of 2-(2-oxo-1H-quinolin-3-yl)-1H-indole-6-sulfonamide?
The IUPAC name of 2-(2-oxo-1H-quinolin-3-yl)-1H-indole-6-sulfonamide (CID 142239743) is 2-(2-oxo-1H-quinolin-3-yl)-1H-indole-6-sulfonamide.
What is the SMILES notation for 2-(2-oxo-1H-quinolin-3-yl)-1H-indole-6-sulfonamide?
The canonical SMILES for 2-(2-oxo-1H-quinolin-3-yl)-1H-indole-6-sulfonamide is NS(=O)(=O)c1ccc2cc(-c3cc4ccccc4[nH]c3=O)[nH]c2c1.
What is the InChIKey of 2-(2-oxo-1H-quinolin-3-yl)-1H-indole-6-sulfonamide?
The InChIKey is XAJNOTRUYBYRQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13N3O3S/c18-24(22,23)12-6-5-11-8-16(19-15(11)9-12)13-7-10-3-1-2-4-14(10)20-17(13)21/h1-9,19H,(H,20,21)(H2,18,22,23).
What are the key properties of 2-(2-oxo-1H-quinolin-3-yl)-1H-indole-6-sulfonamide?
2-(2-oxo-1H-quinolin-3-yl)-1H-indole-6-sulfonamide has a molecular weight of 339.38 g/mol, XLogP of 2.32, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-oxo-1H-quinolin-3-yl)-1H-indole-6-sulfonamide is sourced from PubChem (CID 142239743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).