N-(oxan-4-yl)-N-piperidin-4-ylmethanesulfonamide

C11H22N2O3S — CID 86820423

IUPACN-(oxan-4-yl)-N-piperidin-4-ylmethanesulfonamide
SMILESCS(=O)(=O)N(C1CCNCC1)C1CCOCC1
InChIInChI=1S/C11H22N2O3S/c1-17(14,15)13(10-2-6-12-7-3-10)11-4-8-16-9-5-11/h10-12H,2-9H2,1H3
InChIKeyFRVPHUAAUVSKOM-UHFFFAOYSA-N
MW262.37 g/mol
LogP0.18
Rot. Bonds3

About N-(oxan-4-yl)-N-piperidin-4-ylmethanesulfonamide

N-(oxan-4-yl)-N-piperidin-4-ylmethanesulfonamide (PubChem CID 86820423) has the molecular formula C11H22N2O3S and a molecular weight of 262.37 g/mol. Its IUPAC name is N-(oxan-4-yl)-N-piperidin-4-ylmethanesulfonamide.

Molecular Properties

Compound NameN-(oxan-4-yl)-N-piperidin-4-ylmethanesulfonamide
PubChem CID86820423
Molecular FormulaC11H22N2O3S
Molecular Weight262.37 g/mol
Exact Mass262.14
IUPAC NameN-(oxan-4-yl)-N-piperidin-4-ylmethanesulfonamide
SMILESCS(=O)(=O)N(C1CCNCC1)C1CCOCC1
InChIInChI=1S/C11H22N2O3S/c1-17(14,15)13(10-2-6-12-7-3-10)11-4-8-16-9-5-11/h10-12H,2-9H2,1H3
InChIKeyFRVPHUAAUVSKOM-UHFFFAOYSA-N
XLogP0.18
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.37
LogP ≤ 50.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(oxan-4-yl)-N-piperidin-4-ylmethanesulfonamide 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-(oxan-4-yl)-N-piperidin-4-ylmethanesulfonamide?
The IUPAC name of N-(oxan-4-yl)-N-piperidin-4-ylmethanesulfonamide (CID 86820423) is N-(oxan-4-yl)-N-piperidin-4-ylmethanesulfonamide.
What is the SMILES notation for N-(oxan-4-yl)-N-piperidin-4-ylmethanesulfonamide?
The canonical SMILES for N-(oxan-4-yl)-N-piperidin-4-ylmethanesulfonamide is CS(=O)(=O)N(C1CCNCC1)C1CCOCC1.
What is the InChIKey of N-(oxan-4-yl)-N-piperidin-4-ylmethanesulfonamide?
The InChIKey is FRVPHUAAUVSKOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O3S/c1-17(14,15)13(10-2-6-12-7-3-10)11-4-8-16-9-5-11/h10-12H,2-9H2,1H3.
What are the key properties of N-(oxan-4-yl)-N-piperidin-4-ylmethanesulfonamide?
N-(oxan-4-yl)-N-piperidin-4-ylmethanesulfonamide has a molecular weight of 262.37 g/mol, XLogP of 0.18, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(oxan-4-yl)-N-piperidin-4-ylmethanesulfonamide is sourced from PubChem (CID 86820423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).