N-(1-azaspiro[5.5]undecan-4-yl)-2-methoxyethanesulfonamide

C13H26N2O3S — CID 55014024

IUPACN-(1-azaspiro[5.5]undecan-4-yl)-2-methoxyethanesulfonamide
SMILESCOCCS(=O)(=O)NC1CCNC2(CCCCC2)C1
InChIInChI=1S/C13H26N2O3S/c1-18-9-10-19(16,17)15-12-5-8-14-13(11-12)6-3-2-4-7-13/h12,14-15H,2-11H2,1H3
InChIKeyKKOSSJLUEXVOMB-UHFFFAOYSA-N
MW290.43 g/mol
LogP1.01
Rot. Bonds5

About N-(1-azaspiro[5.5]undecan-4-yl)-2-methoxyethanesulfonamide

N-(1-azaspiro[5.5]undecan-4-yl)-2-methoxyethanesulfonamide (PubChem CID 55014024) has the molecular formula C13H26N2O3S and a molecular weight of 290.43 g/mol. Its IUPAC name is N-(1-azaspiro[5.5]undecan-4-yl)-2-methoxyethanesulfonamide.

Molecular Properties

Compound NameN-(1-azaspiro[5.5]undecan-4-yl)-2-methoxyethanesulfonamide
PubChem CID55014024
Molecular FormulaC13H26N2O3S
Molecular Weight290.43 g/mol
Exact Mass290.17
IUPAC NameN-(1-azaspiro[5.5]undecan-4-yl)-2-methoxyethanesulfonamide
SMILESCOCCS(=O)(=O)NC1CCNC2(CCCCC2)C1
InChIInChI=1S/C13H26N2O3S/c1-18-9-10-19(16,17)15-12-5-8-14-13(11-12)6-3-2-4-7-13/h12,14-15H,2-11H2,1H3
InChIKeyKKOSSJLUEXVOMB-UHFFFAOYSA-N
XLogP1.01
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.43
LogP ≤ 51.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(1-azaspiro[5.5]undecan-4-yl)-2-methoxyethanesulfonamide 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-azaspiro[5.5]undecan-4-yl)-2-methoxyethanesulfonamide?
The IUPAC name of N-(1-azaspiro[5.5]undecan-4-yl)-2-methoxyethanesulfonamide (CID 55014024) is N-(1-azaspiro[5.5]undecan-4-yl)-2-methoxyethanesulfonamide.
What is the SMILES notation for N-(1-azaspiro[5.5]undecan-4-yl)-2-methoxyethanesulfonamide?
The canonical SMILES for N-(1-azaspiro[5.5]undecan-4-yl)-2-methoxyethanesulfonamide is COCCS(=O)(=O)NC1CCNC2(CCCCC2)C1.
What is the InChIKey of N-(1-azaspiro[5.5]undecan-4-yl)-2-methoxyethanesulfonamide?
The InChIKey is KKOSSJLUEXVOMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O3S/c1-18-9-10-19(16,17)15-12-5-8-14-13(11-12)6-3-2-4-7-13/h12,14-15H,2-11H2,1H3.
What are the key properties of N-(1-azaspiro[5.5]undecan-4-yl)-2-methoxyethanesulfonamide?
N-(1-azaspiro[5.5]undecan-4-yl)-2-methoxyethanesulfonamide has a molecular weight of 290.43 g/mol, XLogP of 1.01, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-azaspiro[5.5]undecan-4-yl)-2-methoxyethanesulfonamide is sourced from PubChem (CID 55014024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).