(1,1-dioxo-1,4-thiazinan-4-yl)-piperidin-2-ylmethanone

C10H18N2O3S — CID 43581723

IUPAC(1,1-dioxo-1,4-thiazinan-4-yl)-piperidin-2-ylmethanone
SMILESO=C(C1CCCCN1)N1CCS(=O)(=O)CC1
InChIInChI=1S/C10H18N2O3S/c13-10(9-3-1-2-4-11-9)12-5-7-16(14,15)8-6-12/h9,11H,1-8H2
InChIKeyYLYWSTWNJAOOLJ-UHFFFAOYSA-N
MW246.33 g/mol
LogP-0.61
Rot. Bonds1

About (1,1-dioxo-1,4-thiazinan-4-yl)-piperidin-2-ylmethanone

(1,1-dioxo-1,4-thiazinan-4-yl)-piperidin-2-ylmethanone (PubChem CID 43581723) has the molecular formula C10H18N2O3S and a molecular weight of 246.33 g/mol. Its IUPAC name is (1,1-dioxo-1,4-thiazinan-4-yl)-piperidin-2-ylmethanone.

Molecular Properties

Compound Name(1,1-dioxo-1,4-thiazinan-4-yl)-piperidin-2-ylmethanone
PubChem CID43581723
Molecular FormulaC10H18N2O3S
Molecular Weight246.33 g/mol
Exact Mass246.10
IUPAC Name(1,1-dioxo-1,4-thiazinan-4-yl)-piperidin-2-ylmethanone
SMILESO=C(C1CCCCN1)N1CCS(=O)(=O)CC1
InChIInChI=1S/C10H18N2O3S/c13-10(9-3-1-2-4-11-9)12-5-7-16(14,15)8-6-12/h9,11H,1-8H2
InChIKeyYLYWSTWNJAOOLJ-UHFFFAOYSA-N
XLogP-0.61
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.33
LogP ≤ 5-0.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (1,1-dioxo-1,4-thiazinan-4-yl)-piperidin-2-ylmethanone?
The IUPAC name of (1,1-dioxo-1,4-thiazinan-4-yl)-piperidin-2-ylmethanone (CID 43581723) is (1,1-dioxo-1,4-thiazinan-4-yl)-piperidin-2-ylmethanone.
What is the SMILES notation for (1,1-dioxo-1,4-thiazinan-4-yl)-piperidin-2-ylmethanone?
The canonical SMILES for (1,1-dioxo-1,4-thiazinan-4-yl)-piperidin-2-ylmethanone is O=C(C1CCCCN1)N1CCS(=O)(=O)CC1.
What is the InChIKey of (1,1-dioxo-1,4-thiazinan-4-yl)-piperidin-2-ylmethanone?
The InChIKey is YLYWSTWNJAOOLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O3S/c13-10(9-3-1-2-4-11-9)12-5-7-16(14,15)8-6-12/h9,11H,1-8H2.
What are the key properties of (1,1-dioxo-1,4-thiazinan-4-yl)-piperidin-2-ylmethanone?
(1,1-dioxo-1,4-thiazinan-4-yl)-piperidin-2-ylmethanone has a molecular weight of 246.33 g/mol, XLogP of -0.61, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1,1-dioxo-1,4-thiazinan-4-yl)-piperidin-2-ylmethanone is sourced from PubChem (CID 43581723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).