N-methyl-N-piperidin-4-ylethanesulfonamide

C8H18N2O2S — CID 43606907

IUPACN-methyl-N-piperidin-4-ylethanesulfonamide
SMILESCCS(=O)(=O)N(C)C1CCNCC1
InChIInChI=1S/C8H18N2O2S/c1-3-13(11,12)10(2)8-4-6-9-7-5-8/h8-9H,3-7H2,1-2H3
InChIKeyNQTAMGFZGPHLDV-UHFFFAOYSA-N
MW206.31 g/mol
LogP0.02
Rot. Bonds3

About N-methyl-N-piperidin-4-ylethanesulfonamide

N-methyl-N-piperidin-4-ylethanesulfonamide (PubChem CID 43606907) has the molecular formula C8H18N2O2S and a molecular weight of 206.31 g/mol. Its IUPAC name is N-methyl-N-piperidin-4-ylethanesulfonamide.

Molecular Properties

Compound NameN-methyl-N-piperidin-4-ylethanesulfonamide
PubChem CID43606907
Molecular FormulaC8H18N2O2S
Molecular Weight206.31 g/mol
Exact Mass206.11
IUPAC NameN-methyl-N-piperidin-4-ylethanesulfonamide
SMILESCCS(=O)(=O)N(C)C1CCNCC1
InChIInChI=1S/C8H18N2O2S/c1-3-13(11,12)10(2)8-4-6-9-7-5-8/h8-9H,3-7H2,1-2H3
InChIKeyNQTAMGFZGPHLDV-UHFFFAOYSA-N
XLogP0.02
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.31
LogP ≤ 50.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-methyl-N-piperidin-4-ylethanesulfonamide 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-methyl-N-piperidin-4-ylethanesulfonamide?
The IUPAC name of N-methyl-N-piperidin-4-ylethanesulfonamide (CID 43606907) is N-methyl-N-piperidin-4-ylethanesulfonamide.
What is the SMILES notation for N-methyl-N-piperidin-4-ylethanesulfonamide?
The canonical SMILES for N-methyl-N-piperidin-4-ylethanesulfonamide is CCS(=O)(=O)N(C)C1CCNCC1.
What is the InChIKey of N-methyl-N-piperidin-4-ylethanesulfonamide?
The InChIKey is NQTAMGFZGPHLDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O2S/c1-3-13(11,12)10(2)8-4-6-9-7-5-8/h8-9H,3-7H2,1-2H3.
What are the key properties of N-methyl-N-piperidin-4-ylethanesulfonamide?
N-methyl-N-piperidin-4-ylethanesulfonamide has a molecular weight of 206.31 g/mol, XLogP of 0.02, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-piperidin-4-ylethanesulfonamide is sourced from PubChem (CID 43606907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).