2'-oxospiro[1,3-dioxane-2,3'-1H-indole]-5'-sulfonamide

C11H12N2O5S — CID 68654808

IUPAC2'-oxospiro[1,3-dioxane-2,3'-1H-indole]-5'-sulfonamide
SMILESNS(=O)(=O)c1ccc2c(c1)C1(OCCCO1)C(=O)N2
InChIInChI=1S/C11H12N2O5S/c12-19(15,16)7-2-3-9-8(6-7)11(10(14)13-9)17-4-1-5-18-11/h2-3,6H,1,4-5H2,(H,13,14)(H2,12,15,16)
InChIKeyKZMOCLPYTVVZOO-UHFFFAOYSA-N
MW284.29 g/mol
LogP-0.12
Rot. Bonds1

About 2'-oxospiro[1,3-dioxane-2,3'-1H-indole]-5'-sulfonamide

2'-oxospiro[1,3-dioxane-2,3'-1H-indole]-5'-sulfonamide (PubChem CID 68654808) has the molecular formula C11H12N2O5S and a molecular weight of 284.29 g/mol. Its IUPAC name is 2'-oxospiro[1,3-dioxane-2,3'-1H-indole]-5'-sulfonamide.

Molecular Properties

Compound Name2'-oxospiro[1,3-dioxane-2,3'-1H-indole]-5'-sulfonamide
PubChem CID68654808
Molecular FormulaC11H12N2O5S
Molecular Weight284.29 g/mol
Exact Mass284.05
IUPAC Name2'-oxospiro[1,3-dioxane-2,3'-1H-indole]-5'-sulfonamide
SMILESNS(=O)(=O)c1ccc2c(c1)C1(OCCCO1)C(=O)N2
InChIInChI=1S/C11H12N2O5S/c12-19(15,16)7-2-3-9-8(6-7)11(10(14)13-9)17-4-1-5-18-11/h2-3,6H,1,4-5H2,(H,13,14)(H2,12,15,16)
InChIKeyKZMOCLPYTVVZOO-UHFFFAOYSA-N
XLogP-0.12
TPSA107.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.29
LogP ≤ 5-0.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2'-oxospiro[1,3-dioxane-2,3'-1H-indole]-5'-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2'-oxospiro[1,3-dioxane-2,3'-1H-indole]-5'-sulfonamide?
The IUPAC name of 2'-oxospiro[1,3-dioxane-2,3'-1H-indole]-5'-sulfonamide (CID 68654808) is 2'-oxospiro[1,3-dioxane-2,3'-1H-indole]-5'-sulfonamide.
What is the SMILES notation for 2'-oxospiro[1,3-dioxane-2,3'-1H-indole]-5'-sulfonamide?
The canonical SMILES for 2'-oxospiro[1,3-dioxane-2,3'-1H-indole]-5'-sulfonamide is NS(=O)(=O)c1ccc2c(c1)C1(OCCCO1)C(=O)N2.
What is the InChIKey of 2'-oxospiro[1,3-dioxane-2,3'-1H-indole]-5'-sulfonamide?
The InChIKey is KZMOCLPYTVVZOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O5S/c12-19(15,16)7-2-3-9-8(6-7)11(10(14)13-9)17-4-1-5-18-11/h2-3,6H,1,4-5H2,(H,13,14)(H2,12,15,16).
What are the key properties of 2'-oxospiro[1,3-dioxane-2,3'-1H-indole]-5'-sulfonamide?
2'-oxospiro[1,3-dioxane-2,3'-1H-indole]-5'-sulfonamide has a molecular weight of 284.29 g/mol, XLogP of -0.12, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2'-oxospiro[1,3-dioxane-2,3'-1H-indole]-5'-sulfonamide is sourced from PubChem (CID 68654808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).