1-(2-methoxyacetyl)-2,3-dihydroindole-5-sulfonamide

C11H14N2O4S — CID 60698789

IUPAC1-(2-methoxyacetyl)-2,3-dihydroindole-5-sulfonamide
SMILESCOCC(=O)N1CCc2cc(S(N)(=O)=O)ccc21
InChIInChI=1S/C11H14N2O4S/c1-17-7-11(14)13-5-4-8-6-9(18(12,15)16)2-3-10(8)13/h2-3,6H,4-5,7H2,1H3,(H2,12,15,16)
InChIKeyFKJFXWQVKRCCFX-UHFFFAOYSA-N
MW270.31 g/mol
LogP-0.13
Rot. Bonds3

About 1-(2-methoxyacetyl)-2,3-dihydroindole-5-sulfonamide

1-(2-methoxyacetyl)-2,3-dihydroindole-5-sulfonamide (PubChem CID 60698789) has the molecular formula C11H14N2O4S and a molecular weight of 270.31 g/mol. Its IUPAC name is 1-(2-methoxyacetyl)-2,3-dihydroindole-5-sulfonamide.

Molecular Properties

Compound Name1-(2-methoxyacetyl)-2,3-dihydroindole-5-sulfonamide
PubChem CID60698789
Molecular FormulaC11H14N2O4S
Molecular Weight270.31 g/mol
Exact Mass270.07
IUPAC Name1-(2-methoxyacetyl)-2,3-dihydroindole-5-sulfonamide
SMILESCOCC(=O)N1CCc2cc(S(N)(=O)=O)ccc21
InChIInChI=1S/C11H14N2O4S/c1-17-7-11(14)13-5-4-8-6-9(18(12,15)16)2-3-10(8)13/h2-3,6H,4-5,7H2,1H3,(H2,12,15,16)
InChIKeyFKJFXWQVKRCCFX-UHFFFAOYSA-N
XLogP-0.13
TPSA89.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.31
LogP ≤ 5-0.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-hexanoyl-2,3-dihydroindole-5-sulfonamide
CID 60723591
1-[2-(2-bromophenoxy)acetyl]-2,3-dihydroindole-5-sulfonamide
CID 55448423
1-[2-(2,4,5-trichlorophenoxy)acetyl]-2,3-dihydroindole-5-sulfonamide
CID 27316873
1-but-3-enoyl-2,3-dihydroindole-5-sulfonamide
CID 62678193
N-cyclopentyl-1-(2-methoxyacetyl)-2,3-dihydroindole-5-sulfonamide
CID 19164498
[2-oxo-2-(5-sulfamoyl-2,3-dihydroindol-1-yl)ethyl] naphthalene-2-carboxylate
CID 27310904
[2-oxo-2-(5-sulfamoyl-2,3-dihydroindol-1-yl)ethyl] 2-iodobenzoate
CID 46645204
1-[2-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)amino]acetyl]-2,3-dihydroindole-5-sulfonamide
CID 18284239
[2-oxo-2-(5-sulfamoyl-2,3-dihydroindol-1-yl)ethyl] 2-phenylbenzoate
CID 55448774
[2-oxo-2-(5-sulfamoyl-2,3-dihydroindol-1-yl)ethyl] 2-naphthalen-1-ylacetate
CID 27309776
1-[4-(4-tert-butylphenoxy)butanoyl]-2,3-dihydroindole-5-sulfonamide
CID 17497175
1-(2-phenylsulfanylacetyl)-2,3-dihydroindole-5-sulfonamide
CID 71060712

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyacetyl)-2,3-dihydroindole-5-sulfonamide?
The IUPAC name of 1-(2-methoxyacetyl)-2,3-dihydroindole-5-sulfonamide (CID 60698789) is 1-(2-methoxyacetyl)-2,3-dihydroindole-5-sulfonamide.
What is the SMILES notation for 1-(2-methoxyacetyl)-2,3-dihydroindole-5-sulfonamide?
The canonical SMILES for 1-(2-methoxyacetyl)-2,3-dihydroindole-5-sulfonamide is COCC(=O)N1CCc2cc(S(N)(=O)=O)ccc21.
What is the InChIKey of 1-(2-methoxyacetyl)-2,3-dihydroindole-5-sulfonamide?
The InChIKey is FKJFXWQVKRCCFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O4S/c1-17-7-11(14)13-5-4-8-6-9(18(12,15)16)2-3-10(8)13/h2-3,6H,4-5,7H2,1H3,(H2,12,15,16).
What are the key properties of 1-(2-methoxyacetyl)-2,3-dihydroindole-5-sulfonamide?
1-(2-methoxyacetyl)-2,3-dihydroindole-5-sulfonamide has a molecular weight of 270.31 g/mol, XLogP of -0.13, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyacetyl)-2,3-dihydroindole-5-sulfonamide is sourced from PubChem (CID 60698789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).