N-(5-ethyl-2-methoxyphenyl)-2-oxo-1,3-dihydroindole-5-sulfonamide

C17H18N2O4S — CID 110777264

IUPACN-(5-ethyl-2-methoxyphenyl)-2-oxo-1,3-dihydroindole-5-sulfonamide
SMILESCCc1ccc(OC)c(NS(=O)(=O)c2ccc3c(c2)CC(=O)N3)c1
InChIInChI=1S/C17H18N2O4S/c1-3-11-4-7-16(23-2)15(8-11)19-24(21,22)13-5-6-14-12(9-13)10-17(20)18-14/h4-9,19H,3,10H2,1-2H3,(H,18,20)
InChIKeyPGJKRPDRICBUGK-UHFFFAOYSA-N
MW346.41 g/mol
LogP2.55
Rot. Bonds5

About N-(5-ethyl-2-methoxyphenyl)-2-oxo-1,3-dihydroindole-5-sulfonamide

N-(5-ethyl-2-methoxyphenyl)-2-oxo-1,3-dihydroindole-5-sulfonamide (PubChem CID 110777264) has the molecular formula C17H18N2O4S and a molecular weight of 346.41 g/mol. Its IUPAC name is N-(5-ethyl-2-methoxyphenyl)-2-oxo-1,3-dihydroindole-5-sulfonamide.

Molecular Properties

Compound NameN-(5-ethyl-2-methoxyphenyl)-2-oxo-1,3-dihydroindole-5-sulfonamide
PubChem CID110777264
Molecular FormulaC17H18N2O4S
Molecular Weight346.41 g/mol
Exact Mass346.10
IUPAC NameN-(5-ethyl-2-methoxyphenyl)-2-oxo-1,3-dihydroindole-5-sulfonamide
SMILESCCc1ccc(OC)c(NS(=O)(=O)c2ccc3c(c2)CC(=O)N3)c1
InChIInChI=1S/C17H18N2O4S/c1-3-11-4-7-16(23-2)15(8-11)19-24(21,22)13-5-6-14-12(9-13)10-17(20)18-14/h4-9,19H,3,10H2,1-2H3,(H,18,20)
InChIKeyPGJKRPDRICBUGK-UHFFFAOYSA-N
XLogP2.55
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.41
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(5-ethyl-2-methoxyphenyl)-2-oxo-1,3-dihydroindole-5-sulfonamide?
The IUPAC name of N-(5-ethyl-2-methoxyphenyl)-2-oxo-1,3-dihydroindole-5-sulfonamide (CID 110777264) is N-(5-ethyl-2-methoxyphenyl)-2-oxo-1,3-dihydroindole-5-sulfonamide.
What is the SMILES notation for N-(5-ethyl-2-methoxyphenyl)-2-oxo-1,3-dihydroindole-5-sulfonamide?
The canonical SMILES for N-(5-ethyl-2-methoxyphenyl)-2-oxo-1,3-dihydroindole-5-sulfonamide is CCc1ccc(OC)c(NS(=O)(=O)c2ccc3c(c2)CC(=O)N3)c1.
What is the InChIKey of N-(5-ethyl-2-methoxyphenyl)-2-oxo-1,3-dihydroindole-5-sulfonamide?
The InChIKey is PGJKRPDRICBUGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O4S/c1-3-11-4-7-16(23-2)15(8-11)19-24(21,22)13-5-6-14-12(9-13)10-17(20)18-14/h4-9,19H,3,10H2,1-2H3,(H,18,20).
What are the key properties of N-(5-ethyl-2-methoxyphenyl)-2-oxo-1,3-dihydroindole-5-sulfonamide?
N-(5-ethyl-2-methoxyphenyl)-2-oxo-1,3-dihydroindole-5-sulfonamide has a molecular weight of 346.41 g/mol, XLogP of 2.55, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-ethyl-2-methoxyphenyl)-2-oxo-1,3-dihydroindole-5-sulfonamide is sourced from PubChem (CID 110777264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).