N-ethyl-N-methyl-1,1-dioxo-1,4-thiazinane-4-sulfonamide

C7H16N2O4S2 — CID 58831869

IUPACN-ethyl-N-methyl-1,1-dioxo-1,4-thiazinane-4-sulfonamide
SMILESCCN(C)S(=O)(=O)N1CCS(=O)(=O)CC1
InChIInChI=1S/C7H16N2O4S2/c1-3-8(2)15(12,13)9-4-6-14(10,11)7-5-9/h3-7H2,1-2H3
InChIKeyASOAFPSXWFJPML-UHFFFAOYSA-N
MW256.35 g/mol
LogP-1.09
Rot. Bonds3

About N-ethyl-N-methyl-1,1-dioxo-1,4-thiazinane-4-sulfonamide

N-ethyl-N-methyl-1,1-dioxo-1,4-thiazinane-4-sulfonamide (PubChem CID 58831869) has the molecular formula C7H16N2O4S2 and a molecular weight of 256.35 g/mol. Its IUPAC name is N-ethyl-N-methyl-1,1-dioxo-1,4-thiazinane-4-sulfonamide.

Molecular Properties

Compound NameN-ethyl-N-methyl-1,1-dioxo-1,4-thiazinane-4-sulfonamide
PubChem CID58831869
Molecular FormulaC7H16N2O4S2
Molecular Weight256.35 g/mol
Exact Mass256.06
IUPAC NameN-ethyl-N-methyl-1,1-dioxo-1,4-thiazinane-4-sulfonamide
SMILESCCN(C)S(=O)(=O)N1CCS(=O)(=O)CC1
InChIInChI=1S/C7H16N2O4S2/c1-3-8(2)15(12,13)9-4-6-14(10,11)7-5-9/h3-7H2,1-2H3
InChIKeyASOAFPSXWFJPML-UHFFFAOYSA-N
XLogP-1.09
TPSA74.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 5-1.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-ethyl-N-methyl-1,1-dioxo-1,4-thiazinane-4-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-ethyl-N-methyl-1,1-dioxo-1,4-thiazinane-4-sulfonamide?
The IUPAC name of N-ethyl-N-methyl-1,1-dioxo-1,4-thiazinane-4-sulfonamide (CID 58831869) is N-ethyl-N-methyl-1,1-dioxo-1,4-thiazinane-4-sulfonamide.
What is the SMILES notation for N-ethyl-N-methyl-1,1-dioxo-1,4-thiazinane-4-sulfonamide?
The canonical SMILES for N-ethyl-N-methyl-1,1-dioxo-1,4-thiazinane-4-sulfonamide is CCN(C)S(=O)(=O)N1CCS(=O)(=O)CC1.
What is the InChIKey of N-ethyl-N-methyl-1,1-dioxo-1,4-thiazinane-4-sulfonamide?
The InChIKey is ASOAFPSXWFJPML-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O4S2/c1-3-8(2)15(12,13)9-4-6-14(10,11)7-5-9/h3-7H2,1-2H3.
What are the key properties of N-ethyl-N-methyl-1,1-dioxo-1,4-thiazinane-4-sulfonamide?
N-ethyl-N-methyl-1,1-dioxo-1,4-thiazinane-4-sulfonamide has a molecular weight of 256.35 g/mol, XLogP of -1.09, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methyl-1,1-dioxo-1,4-thiazinane-4-sulfonamide is sourced from PubChem (CID 58831869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).