cyclohexyl-(1,1-dioxo-1,4-thiazinan-4-yl)methanone

C11H19NO3S — CID 71933484

IUPACcyclohexyl-(1,1-dioxo-1,4-thiazinan-4-yl)methanone
SMILESO=C(C1CCCCC1)N1CCS(=O)(=O)CC1
InChIInChI=1S/C11H19NO3S/c13-11(10-4-2-1-3-5-10)12-6-8-16(14,15)9-7-12/h10H,1-9H2
InChIKeyJGPAIEGDINYFLT-UHFFFAOYSA-N
MW245.34 g/mol
LogP0.82
Rot. Bonds1

About cyclohexyl-(1,1-dioxo-1,4-thiazinan-4-yl)methanone

cyclohexyl-(1,1-dioxo-1,4-thiazinan-4-yl)methanone (PubChem CID 71933484) has the molecular formula C11H19NO3S and a molecular weight of 245.34 g/mol. Its IUPAC name is cyclohexyl-(1,1-dioxo-1,4-thiazinan-4-yl)methanone.

Molecular Properties

Compound Namecyclohexyl-(1,1-dioxo-1,4-thiazinan-4-yl)methanone
PubChem CID71933484
Molecular FormulaC11H19NO3S
Molecular Weight245.34 g/mol
Exact Mass245.11
IUPAC Namecyclohexyl-(1,1-dioxo-1,4-thiazinan-4-yl)methanone
SMILESO=C(C1CCCCC1)N1CCS(=O)(=O)CC1
InChIInChI=1S/C11H19NO3S/c13-11(10-4-2-1-3-5-10)12-6-8-16(14,15)9-7-12/h10H,1-9H2
InChIKeyJGPAIEGDINYFLT-UHFFFAOYSA-N
XLogP0.82
TPSA54.45 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.34
LogP ≤ 50.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze cyclohexyl-(1,1-dioxo-1,4-thiazinan-4-yl)methanone 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 cyclohexyl-(1,1-dioxo-1,4-thiazinan-4-yl)methanone?
The IUPAC name of cyclohexyl-(1,1-dioxo-1,4-thiazinan-4-yl)methanone (CID 71933484) is cyclohexyl-(1,1-dioxo-1,4-thiazinan-4-yl)methanone.
What is the SMILES notation for cyclohexyl-(1,1-dioxo-1,4-thiazinan-4-yl)methanone?
The canonical SMILES for cyclohexyl-(1,1-dioxo-1,4-thiazinan-4-yl)methanone is O=C(C1CCCCC1)N1CCS(=O)(=O)CC1.
What is the InChIKey of cyclohexyl-(1,1-dioxo-1,4-thiazinan-4-yl)methanone?
The InChIKey is JGPAIEGDINYFLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO3S/c13-11(10-4-2-1-3-5-10)12-6-8-16(14,15)9-7-12/h10H,1-9H2.
What are the key properties of cyclohexyl-(1,1-dioxo-1,4-thiazinan-4-yl)methanone?
cyclohexyl-(1,1-dioxo-1,4-thiazinan-4-yl)methanone has a molecular weight of 245.34 g/mol, XLogP of 0.82, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl-(1,1-dioxo-1,4-thiazinan-4-yl)methanone is sourced from PubChem (CID 71933484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).