3-methoxythiazinane 1,1-dioxide

C5H11NO3S — CID 57265686

IUPAC3-methoxythiazinane 1,1-dioxide
SMILESCOC1CCCS(=O)(=O)N1
InChIInChI=1S/C5H11NO3S/c1-9-5-3-2-4-10(7,8)6-5/h5-6H,2-4H2,1H3
InChIKeyDXHJHINBIREBQB-UHFFFAOYSA-N
MW165.21 g/mol
LogP-0.33
Rot. Bonds1

About 3-methoxythiazinane 1,1-dioxide

3-methoxythiazinane 1,1-dioxide (PubChem CID 57265686) has the molecular formula C5H11NO3S and a molecular weight of 165.21 g/mol. Its IUPAC name is 3-methoxythiazinane 1,1-dioxide.

Molecular Properties

Compound Name3-methoxythiazinane 1,1-dioxide
PubChem CID57265686
Molecular FormulaC5H11NO3S
Molecular Weight165.21 g/mol
Exact Mass165.05
IUPAC Name3-methoxythiazinane 1,1-dioxide
SMILESCOC1CCCS(=O)(=O)N1
InChIInChI=1S/C5H11NO3S/c1-9-5-3-2-4-10(7,8)6-5/h5-6H,2-4H2,1H3
InChIKeyDXHJHINBIREBQB-UHFFFAOYSA-N
XLogP-0.33
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.21
LogP ≤ 5-0.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-methoxythiazinane 1,1-dioxide?
The IUPAC name of 3-methoxythiazinane 1,1-dioxide (CID 57265686) is 3-methoxythiazinane 1,1-dioxide.
What is the SMILES notation for 3-methoxythiazinane 1,1-dioxide?
The canonical SMILES for 3-methoxythiazinane 1,1-dioxide is COC1CCCS(=O)(=O)N1.
What is the InChIKey of 3-methoxythiazinane 1,1-dioxide?
The InChIKey is DXHJHINBIREBQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NO3S/c1-9-5-3-2-4-10(7,8)6-5/h5-6H,2-4H2,1H3.
What are the key properties of 3-methoxythiazinane 1,1-dioxide?
3-methoxythiazinane 1,1-dioxide has a molecular weight of 165.21 g/mol, XLogP of -0.33, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxythiazinane 1,1-dioxide is sourced from PubChem (CID 57265686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).