N-[2-(2-oxo-1,3-dihydroindol-5-yl)ethyl]propane-1-sulfonamide

C13H18N2O3S — CID 110788490

IUPACN-[2-(2-oxo-1,3-dihydroindol-5-yl)ethyl]propane-1-sulfonamide
SMILESCCCS(=O)(=O)NCCc1ccc2c(c1)CC(=O)N2
InChIInChI=1S/C13H18N2O3S/c1-2-7-19(17,18)14-6-5-10-3-4-12-11(8-10)9-13(16)15-12/h3-4,8,14H,2,5-7,9H2,1H3,(H,15,16)
InChIKeyVBFFAPQTRIORJC-UHFFFAOYSA-N
MW282.37 g/mol
LogP1.05
Rot. Bonds6

About N-[2-(2-oxo-1,3-dihydroindol-5-yl)ethyl]propane-1-sulfonamide

N-[2-(2-oxo-1,3-dihydroindol-5-yl)ethyl]propane-1-sulfonamide (PubChem CID 110788490) has the molecular formula C13H18N2O3S and a molecular weight of 282.37 g/mol. Its IUPAC name is N-[2-(2-oxo-1,3-dihydroindol-5-yl)ethyl]propane-1-sulfonamide.

Molecular Properties

Compound NameN-[2-(2-oxo-1,3-dihydroindol-5-yl)ethyl]propane-1-sulfonamide
PubChem CID110788490
Molecular FormulaC13H18N2O3S
Molecular Weight282.37 g/mol
Exact Mass282.10
IUPAC NameN-[2-(2-oxo-1,3-dihydroindol-5-yl)ethyl]propane-1-sulfonamide
SMILESCCCS(=O)(=O)NCCc1ccc2c(c1)CC(=O)N2
InChIInChI=1S/C13H18N2O3S/c1-2-7-19(17,18)14-6-5-10-3-4-12-11(8-10)9-13(16)15-12/h3-4,8,14H,2,5-7,9H2,1H3,(H,15,16)
InChIKeyVBFFAPQTRIORJC-UHFFFAOYSA-N
XLogP1.05
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.37
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]butane-1-sulfonamide
CID 110788676
5-butyl-1,3-dihydroindol-2-one
CID 10219749
4-fluoro-N-[2-(2-oxo-1,3-dihydroindol-5-yl)ethyl]benzenesulfonamide
CID 110788495
5-[2-(hydroxymethylamino)ethyl]-1,3-dihydroindol-2-one
CID 115229299
2-[2-(2-oxo-1,3-dihydroindol-5-yl)ethylamino]acetaldehyde
CID 115223207
5-[2-[3-(methylamino)propylamino]ethyl]-1,3-dihydroindol-2-one
CID 115197988
5-[2-(hydrazinylmethylamino)ethyl]-1,3-dihydroindol-2-one
CID 115261107
N-[2-(4-chlorophenyl)ethyl]-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 113098245
5-(2-hydroxyethyl)-1,3-dihydroindol-2-one
CID 22131131
3-[2-(2-oxo-1,3-dihydroindol-5-yl)ethylamino]propanoic acid
CID 112518611
1-cyano-N-[2-(2-oxo-1,3-dihydroindol-5-yl)ethyl]formamide
CID 115172488
5-[3-(cyclopentylamino)propyl]-1,3-dihydroindol-2-one
CID 98016927

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-oxo-1,3-dihydroindol-5-yl)ethyl]propane-1-sulfonamide?
The IUPAC name of N-[2-(2-oxo-1,3-dihydroindol-5-yl)ethyl]propane-1-sulfonamide (CID 110788490) is N-[2-(2-oxo-1,3-dihydroindol-5-yl)ethyl]propane-1-sulfonamide.
What is the SMILES notation for N-[2-(2-oxo-1,3-dihydroindol-5-yl)ethyl]propane-1-sulfonamide?
The canonical SMILES for N-[2-(2-oxo-1,3-dihydroindol-5-yl)ethyl]propane-1-sulfonamide is CCCS(=O)(=O)NCCc1ccc2c(c1)CC(=O)N2.
What is the InChIKey of N-[2-(2-oxo-1,3-dihydroindol-5-yl)ethyl]propane-1-sulfonamide?
The InChIKey is VBFFAPQTRIORJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O3S/c1-2-7-19(17,18)14-6-5-10-3-4-12-11(8-10)9-13(16)15-12/h3-4,8,14H,2,5-7,9H2,1H3,(H,15,16).
What are the key properties of N-[2-(2-oxo-1,3-dihydroindol-5-yl)ethyl]propane-1-sulfonamide?
N-[2-(2-oxo-1,3-dihydroindol-5-yl)ethyl]propane-1-sulfonamide has a molecular weight of 282.37 g/mol, XLogP of 1.05, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-oxo-1,3-dihydroindol-5-yl)ethyl]propane-1-sulfonamide is sourced from PubChem (CID 110788490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).