2-methylsulfonyl-N-(piperidin-2-ylmethyl)ethanesulfonamide

C9H20N2O4S2 — CID 63245222

IUPAC2-methylsulfonyl-N-(piperidin-2-ylmethyl)ethanesulfonamide
SMILESCS(=O)(=O)CCS(=O)(=O)NCC1CCCCN1
InChIInChI=1S/C9H20N2O4S2/c1-16(12,13)6-7-17(14,15)11-8-9-4-2-3-5-10-9/h9-11H,2-8H2,1H3
InChIKeyPXZXQDUJQWXWJD-UHFFFAOYSA-N
MW284.40 g/mol
LogP-0.91
Rot. Bonds6

About 2-methylsulfonyl-N-(piperidin-2-ylmethyl)ethanesulfonamide

2-methylsulfonyl-N-(piperidin-2-ylmethyl)ethanesulfonamide (PubChem CID 63245222) has the molecular formula C9H20N2O4S2 and a molecular weight of 284.40 g/mol. Its IUPAC name is 2-methylsulfonyl-N-(piperidin-2-ylmethyl)ethanesulfonamide.

Molecular Properties

Compound Name2-methylsulfonyl-N-(piperidin-2-ylmethyl)ethanesulfonamide
PubChem CID63245222
Molecular FormulaC9H20N2O4S2
Molecular Weight284.40 g/mol
Exact Mass284.09
IUPAC Name2-methylsulfonyl-N-(piperidin-2-ylmethyl)ethanesulfonamide
SMILESCS(=O)(=O)CCS(=O)(=O)NCC1CCCCN1
InChIInChI=1S/C9H20N2O4S2/c1-16(12,13)6-7-17(14,15)11-8-9-4-2-3-5-10-9/h9-11H,2-8H2,1H3
InChIKeyPXZXQDUJQWXWJD-UHFFFAOYSA-N
XLogP-0.91
TPSA92.34 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 5-0.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-methylsulfonyl-N-(piperidin-2-ylmethyl)ethanesulfonamide with MolForge

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

Launch Full Analysis

Related Compounds

2-methylsulfonyl-N-(piperidin-2-ylmethyl)ethanamine
CID 84686147
2-methylsulfonyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]ethanesulfonamide;hydrochloride
CID 120723401
N-(piperidin-2-ylmethyl)-2-propan-2-yloxyethanesulfonamide
CID 79593606
N-(pyrrolidin-2-ylmethyl)methanesulfonamide
CID 59418450
1-cyclopentyl-N-[[(2R)-pyrrolidin-2-yl]methyl]methanesulfonamide
CID 121497367
N-(cyclohexylmethyl)-2-piperidin-2-ylethanesulfonamide
CID 60863668
N-[2-(methanesulfonamido)ethyl]-2-piperidin-2-ylethanesulfonamide
CID 60863842
N-(piperidin-2-ylmethylsulfamoyl)propan-2-amine
CID 114807413
1-cyclohexyl-N-(pyrrolidin-2-ylmethyl)methanesulfonamide;hydrochloride
CID 119974331
2-methylsulfonyl-N-(piperidin-4-ylmethyl)ethanesulfonamide
CID 63245223
3-methylsulfonyl-N-(pyrrolidin-2-ylmethyl)propan-1-amine
CID 106638054
N-(2-piperidin-2-ylethyl)propane-1-sulfonamide
CID 24703797

Frequently Asked Questions

What is the IUPAC name of 2-methylsulfonyl-N-(piperidin-2-ylmethyl)ethanesulfonamide?
The IUPAC name of 2-methylsulfonyl-N-(piperidin-2-ylmethyl)ethanesulfonamide (CID 63245222) is 2-methylsulfonyl-N-(piperidin-2-ylmethyl)ethanesulfonamide.
What is the SMILES notation for 2-methylsulfonyl-N-(piperidin-2-ylmethyl)ethanesulfonamide?
The canonical SMILES for 2-methylsulfonyl-N-(piperidin-2-ylmethyl)ethanesulfonamide is CS(=O)(=O)CCS(=O)(=O)NCC1CCCCN1.
What is the InChIKey of 2-methylsulfonyl-N-(piperidin-2-ylmethyl)ethanesulfonamide?
The InChIKey is PXZXQDUJQWXWJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O4S2/c1-16(12,13)6-7-17(14,15)11-8-9-4-2-3-5-10-9/h9-11H,2-8H2,1H3.
What are the key properties of 2-methylsulfonyl-N-(piperidin-2-ylmethyl)ethanesulfonamide?
2-methylsulfonyl-N-(piperidin-2-ylmethyl)ethanesulfonamide has a molecular weight of 284.40 g/mol, XLogP of -0.91, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylsulfonyl-N-(piperidin-2-ylmethyl)ethanesulfonamide is sourced from PubChem (CID 63245222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).