N-(1,4-dioxaspiro[4.5]decan-8-yl)propane-1-sulfonamide

C11H21NO4S — CID 47387385

IUPACN-(1,4-dioxaspiro[4.5]decan-8-yl)propane-1-sulfonamide
SMILESCCCS(=O)(=O)NC1CCC2(CC1)OCCO2
InChIInChI=1S/C11H21NO4S/c1-2-9-17(13,14)12-10-3-5-11(6-4-10)15-7-8-16-11/h10,12H,2-9H2,1H3
InChIKeyZVZODAAMJLHANQ-UHFFFAOYSA-N
MW263.36 g/mol
LogP1.00
Rot. Bonds4

About N-(1,4-dioxaspiro[4.5]decan-8-yl)propane-1-sulfonamide

N-(1,4-dioxaspiro[4.5]decan-8-yl)propane-1-sulfonamide (PubChem CID 47387385) has the molecular formula C11H21NO4S and a molecular weight of 263.36 g/mol. Its IUPAC name is N-(1,4-dioxaspiro[4.5]decan-8-yl)propane-1-sulfonamide.

Molecular Properties

Compound NameN-(1,4-dioxaspiro[4.5]decan-8-yl)propane-1-sulfonamide
PubChem CID47387385
Molecular FormulaC11H21NO4S
Molecular Weight263.36 g/mol
Exact Mass263.12
IUPAC NameN-(1,4-dioxaspiro[4.5]decan-8-yl)propane-1-sulfonamide
SMILESCCCS(=O)(=O)NC1CCC2(CC1)OCCO2
InChIInChI=1S/C11H21NO4S/c1-2-9-17(13,14)12-10-3-5-11(6-4-10)15-7-8-16-11/h10,12H,2-9H2,1H3
InChIKeyZVZODAAMJLHANQ-UHFFFAOYSA-N
XLogP1.00
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.36
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(1,4-dioxaspiro[4.5]decan-8-yl)propane-1-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 N-(1,4-dioxaspiro[4.5]decan-8-yl)propane-1-sulfonamide?
The IUPAC name of N-(1,4-dioxaspiro[4.5]decan-8-yl)propane-1-sulfonamide (CID 47387385) is N-(1,4-dioxaspiro[4.5]decan-8-yl)propane-1-sulfonamide.
What is the SMILES notation for N-(1,4-dioxaspiro[4.5]decan-8-yl)propane-1-sulfonamide?
The canonical SMILES for N-(1,4-dioxaspiro[4.5]decan-8-yl)propane-1-sulfonamide is CCCS(=O)(=O)NC1CCC2(CC1)OCCO2.
What is the InChIKey of N-(1,4-dioxaspiro[4.5]decan-8-yl)propane-1-sulfonamide?
The InChIKey is ZVZODAAMJLHANQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO4S/c1-2-9-17(13,14)12-10-3-5-11(6-4-10)15-7-8-16-11/h10,12H,2-9H2,1H3.
What are the key properties of N-(1,4-dioxaspiro[4.5]decan-8-yl)propane-1-sulfonamide?
N-(1,4-dioxaspiro[4.5]decan-8-yl)propane-1-sulfonamide has a molecular weight of 263.36 g/mol, XLogP of 1.00, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,4-dioxaspiro[4.5]decan-8-yl)propane-1-sulfonamide is sourced from PubChem (CID 47387385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).