5-(methoxymethyl)-2-methyl-1,4-thiazinane 1,1-dioxide

C7H15NO3S — CID 107511162

IUPAC5-(methoxymethyl)-2-methyl-1,4-thiazinane 1,1-dioxide
SMILESCOCC1CS(=O)(=O)C(C)CN1
InChIInChI=1S/C7H15NO3S/c1-6-3-8-7(4-11-2)5-12(6,9)10/h6-8H,3-5H2,1-2H3
InChIKeyRLVUBYAWSZOFEE-UHFFFAOYSA-N
MW193.27 g/mol
LogP-0.59
Rot. Bonds2

About 5-(methoxymethyl)-2-methyl-1,4-thiazinane 1,1-dioxide

5-(methoxymethyl)-2-methyl-1,4-thiazinane 1,1-dioxide (PubChem CID 107511162) has the molecular formula C7H15NO3S and a molecular weight of 193.27 g/mol. Its IUPAC name is 5-(methoxymethyl)-2-methyl-1,4-thiazinane 1,1-dioxide.

Molecular Properties

Compound Name5-(methoxymethyl)-2-methyl-1,4-thiazinane 1,1-dioxide
PubChem CID107511162
Molecular FormulaC7H15NO3S
Molecular Weight193.27 g/mol
Exact Mass193.08
IUPAC Name5-(methoxymethyl)-2-methyl-1,4-thiazinane 1,1-dioxide
SMILESCOCC1CS(=O)(=O)C(C)CN1
InChIInChI=1S/C7H15NO3S/c1-6-3-8-7(4-11-2)5-12(6,9)10/h6-8H,3-5H2,1-2H3
InChIKeyRLVUBYAWSZOFEE-UHFFFAOYSA-N
XLogP-0.59
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.27
LogP ≤ 5-0.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(methoxymethyl)-5-methyl-1,4-thiazinane 1,1-dioxide
CID 107511165
3-(methoxymethyl)-5-methyl-1,4-thiazepane 1,1-dioxide
CID 107511171
2-(methoxymethyl)azetidine
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(2S,4S)-4-methoxy-2-(methoxymethyl)pyrrolidine;hydrochloride
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(3S,5R)-5-(methoxymethyl)pyrrolidin-3-ol;hydrochloride
CID 155904303
ethane;5-(methoxymethyl)pyrrolidin-3-ol
CID 162382010
4-methoxy-2-(methoxymethyl)pyrrolidine;hydrochloride
CID 122236424
3-(methoxymethyl)-1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinoline
CID 22981542
2-(methoxymethyl)piperazine;dihydrochloride
CID 66941255
(2R,4R)-2-ethyl-4-(methoxymethyl)pyrrolidine
CID 178147098
(2R)-2-(methoxymethyl)piperazine;dihydrochloride
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3-[2-(methoxymethyl)piperidin-4-yl]thiolane 1,1-dioxide
CID 117258436

Frequently Asked Questions

What is the IUPAC name of 5-(methoxymethyl)-2-methyl-1,4-thiazinane 1,1-dioxide?
The IUPAC name of 5-(methoxymethyl)-2-methyl-1,4-thiazinane 1,1-dioxide (CID 107511162) is 5-(methoxymethyl)-2-methyl-1,4-thiazinane 1,1-dioxide.
What is the SMILES notation for 5-(methoxymethyl)-2-methyl-1,4-thiazinane 1,1-dioxide?
The canonical SMILES for 5-(methoxymethyl)-2-methyl-1,4-thiazinane 1,1-dioxide is COCC1CS(=O)(=O)C(C)CN1.
What is the InChIKey of 5-(methoxymethyl)-2-methyl-1,4-thiazinane 1,1-dioxide?
The InChIKey is RLVUBYAWSZOFEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO3S/c1-6-3-8-7(4-11-2)5-12(6,9)10/h6-8H,3-5H2,1-2H3.
What are the key properties of 5-(methoxymethyl)-2-methyl-1,4-thiazinane 1,1-dioxide?
5-(methoxymethyl)-2-methyl-1,4-thiazinane 1,1-dioxide has a molecular weight of 193.27 g/mol, XLogP of -0.59, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(methoxymethyl)-2-methyl-1,4-thiazinane 1,1-dioxide is sourced from PubChem (CID 107511162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).