6-methylthiazinane 1,1-dioxide

C5H11NO2S — CID 54518329

IUPAC6-methylthiazinane 1,1-dioxide
SMILESCC1CCCNS1(=O)=O
InChIInChI=1S/C5H11NO2S/c1-5-3-2-4-6-9(5,7)8/h5-6H,2-4H2,1H3
InChIKeyYNZCUJARGIHWDE-UHFFFAOYSA-N
MW149.21 g/mol
LogP0.09
Rot. Bonds

About 6-methylthiazinane 1,1-dioxide

6-methylthiazinane 1,1-dioxide (PubChem CID 54518329) has the molecular formula C5H11NO2S and a molecular weight of 149.21 g/mol. Its IUPAC name is 6-methylthiazinane 1,1-dioxide.

Molecular Properties

Compound Name6-methylthiazinane 1,1-dioxide
PubChem CID54518329
Molecular FormulaC5H11NO2S
Molecular Weight149.21 g/mol
Exact Mass149.05
IUPAC Name6-methylthiazinane 1,1-dioxide
SMILESCC1CCCNS1(=O)=O
InChIInChI=1S/C5H11NO2S/c1-5-3-2-4-6-9(5,7)8/h5-6H,2-4H2,1H3
InChIKeyYNZCUJARGIHWDE-UHFFFAOYSA-N
XLogP0.09
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.21
LogP ≤ 50.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1,4-Butanesultam
CID 303508
N-Methyl-4-piperidinesulfonamide
CID 52326748
N-methylpiperidine-3-sulfonamide
CID 24711203
6,6-Dimethyl-1lambda6,2-thiazinane-1,1-dione
CID 132372756
N-amyl-n-butanesulfamide
CID 303123
3-Methylthiazinane 1,1-dioxide
CID 68467656
3-Ethylthiazinane 1,1-dioxide
CID 85782130
4-Iodothiazinane 1,1-dioxide
CID 155931220
6-Fluoro-1,2-thiazinane-1,1-dioxide
CID 86702146
(R)-3-Methyl-1,2-thiazinane 1,1-dioxide
CID 102176292
Sulfamylbutansultam
CID 129634301
N-pentylethanesulfonamide
CID 3613996

Frequently Asked Questions

What is the IUPAC name of 6-methylthiazinane 1,1-dioxide?
The IUPAC name of 6-methylthiazinane 1,1-dioxide (CID 54518329) is 6-methylthiazinane 1,1-dioxide.
What is the SMILES notation for 6-methylthiazinane 1,1-dioxide?
The canonical SMILES for 6-methylthiazinane 1,1-dioxide is CC1CCCNS1(=O)=O.
What is the InChIKey of 6-methylthiazinane 1,1-dioxide?
The InChIKey is YNZCUJARGIHWDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NO2S/c1-5-3-2-4-6-9(5,7)8/h5-6H,2-4H2,1H3.
What are the key properties of 6-methylthiazinane 1,1-dioxide?
6-methylthiazinane 1,1-dioxide has a molecular weight of 149.21 g/mol, XLogP of 0.09, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methylthiazinane 1,1-dioxide is sourced from PubChem (CID 54518329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).