methane;4-methyl-2,3-dihydro-1,4-thiazine 1,1-dioxide

C6H13NO2S — CID 159364196

IUPACmethane;4-methyl-2,3-dihydro-1,4-thiazine 1,1-dioxide
SMILESC.CN1C=CS(=O)(=O)CC1
InChIInChI=1S/C5H9NO2S.CH4/c1-6-2-4-9(7,8)5-3-6;/h2,4H,3,5H2,1H3;1H4
InChIKeyLIXOABBQPLFWGW-UHFFFAOYSA-N
MW163.24 g/mol
LogP0.45
Rot. Bonds

About methane;4-methyl-2,3-dihydro-1,4-thiazine 1,1-dioxide

methane;4-methyl-2,3-dihydro-1,4-thiazine 1,1-dioxide (PubChem CID 159364196) has the molecular formula C6H13NO2S and a molecular weight of 163.24 g/mol. Its IUPAC name is methane;4-methyl-2,3-dihydro-1,4-thiazine 1,1-dioxide.

Molecular Properties

Compound Namemethane;4-methyl-2,3-dihydro-1,4-thiazine 1,1-dioxide
PubChem CID159364196
Molecular FormulaC6H13NO2S
Molecular Weight163.24 g/mol
Exact Mass163.07
IUPAC Namemethane;4-methyl-2,3-dihydro-1,4-thiazine 1,1-dioxide
SMILESC.CN1C=CS(=O)(=O)CC1
InChIInChI=1S/C5H9NO2S.CH4/c1-6-2-4-9(7,8)5-3-6;/h2,4H,3,5H2,1H3;1H4
InChIKeyLIXOABBQPLFWGW-UHFFFAOYSA-N
XLogP0.45
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.24
LogP ≤ 50.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(Ethenesulfonyl)-N,N-dimethylethan-1-amine
CID 305589
(E)-N,N-dimethyl-2-methylsulfonylethenamine
CID 12950462
4-Methyl-2,3-dihydro-1,4-thiazine 1,1-dioxide
CID 20813961
4-Ethenyl-1,4-thiazinane 1,1-dioxide
CID 58283302
2,3,4-Trimethyl-1,4-thiazine 1,1-dioxide
CID 117884543
2,3-dimethyl-2H-1,3-thiazole 1,1-dioxide
CID 123612562
2-[2-(dimethylamino)ethenylsulfonyl]-N,N-dimethylethenamine
CID 139878543
2-[Ethenyl(methyl)amino]ethanesulfonic acid
CID 141094385
N,N-bis(ethenyl)ethanesulfonamide
CID 141586396
4-Methyl-2,3-dihydro-1,4-thiazine 1-oxide
CID 145467203
2-[(E)-2-isocyanoethenyl]sulfonylpropane
CID 162494839
4,6-Dimethyl-2,3-dihydro-1,4-thiazine 1,1-dioxide
CID 164763542

Frequently Asked Questions

What is the IUPAC name of methane;4-methyl-2,3-dihydro-1,4-thiazine 1,1-dioxide?
The IUPAC name of methane;4-methyl-2,3-dihydro-1,4-thiazine 1,1-dioxide (CID 159364196) is methane;4-methyl-2,3-dihydro-1,4-thiazine 1,1-dioxide.
What is the SMILES notation for methane;4-methyl-2,3-dihydro-1,4-thiazine 1,1-dioxide?
The canonical SMILES for methane;4-methyl-2,3-dihydro-1,4-thiazine 1,1-dioxide is C.CN1C=CS(=O)(=O)CC1.
What is the InChIKey of methane;4-methyl-2,3-dihydro-1,4-thiazine 1,1-dioxide?
The InChIKey is LIXOABBQPLFWGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9NO2S.CH4/c1-6-2-4-9(7,8)5-3-6;/h2,4H,3,5H2,1H3;1H4.
What are the key properties of methane;4-methyl-2,3-dihydro-1,4-thiazine 1,1-dioxide?
methane;4-methyl-2,3-dihydro-1,4-thiazine 1,1-dioxide has a molecular weight of 163.24 g/mol, XLogP of 0.45, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methane;4-methyl-2,3-dihydro-1,4-thiazine 1,1-dioxide is sourced from PubChem (CID 159364196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).