4,5-dimethyl-2,3-dihydro-1,4-thiazine 1,1-dioxide

C6H11NO2S — CID 24975881

IUPAC4,5-dimethyl-2,3-dihydro-1,4-thiazine 1,1-dioxide
SMILESCC1=CS(=O)(=O)CCN1C
InChIInChI=1S/C6H11NO2S/c1-6-5-10(8,9)4-3-7(6)2/h5H,3-4H2,1-2H3
InChIKeyPZSBKLPUTYBREM-UHFFFAOYSA-N
MW161.23 g/mol
LogP0.21
Rot. Bonds

About 4,5-dimethyl-2,3-dihydro-1,4-thiazine 1,1-dioxide

4,5-dimethyl-2,3-dihydro-1,4-thiazine 1,1-dioxide (PubChem CID 24975881) has the molecular formula C6H11NO2S and a molecular weight of 161.23 g/mol. Its IUPAC name is 4,5-dimethyl-2,3-dihydro-1,4-thiazine 1,1-dioxide.

Molecular Properties

Compound Name4,5-dimethyl-2,3-dihydro-1,4-thiazine 1,1-dioxide
PubChem CID24975881
Molecular FormulaC6H11NO2S
Molecular Weight161.23 g/mol
Exact Mass161.05
IUPAC Name4,5-dimethyl-2,3-dihydro-1,4-thiazine 1,1-dioxide
SMILESCC1=CS(=O)(=O)CCN1C
InChIInChI=1S/C6H11NO2S/c1-6-5-10(8,9)4-3-7(6)2/h5H,3-4H2,1-2H3
InChIKeyPZSBKLPUTYBREM-UHFFFAOYSA-N
XLogP0.21
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.23
LogP ≤ 50.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

n,n-Dimethyl-2h-thiet-3-amine 1,1-dioxide
CID 282202
N,N-diethyl-2-methyl-1,1-dioxo-2H-thiet-3-amine
CID 12845636
4,5-Dimethyl-2,3-dihydro-1,4-thiazine 1-oxide
CID 134923010
4-Methyl-3-methylidene-1,4-thiazinane 1-oxide
CID 57557910
4-Methyl-3-methylidene-1,4-thiazinane 1,1-dioxide
CID 59520041
5-methyl-3,4-dihydro-2H-1,4-thiazine 1,1-dioxide
CID 68099585
4-Prop-1-en-2-yl-1,4-thiazinane 1,1-dioxide
CID 68271847
(E)-N-methyl-2-methylsulfonyl-N-prop-1-en-2-ylprop-1-en-1-amine
CID 88936545
(2R,3S)-2,3,4-trimethyl-5-methylidene-1,4-thiazinane 1,1-dioxide
CID 89377947
Ethane;4-methyl-3-methylidene-1,4-thiazinane 1,1-dioxide
CID 90687463
2,3,4-Trimethyl-1,4-thiazine 1,1-dioxide
CID 117884543
4-But-2-en-2-yl-1,4-thiazinane 1,1-dioxide
CID 123875902

Frequently Asked Questions

What is the IUPAC name of 4,5-dimethyl-2,3-dihydro-1,4-thiazine 1,1-dioxide?
The IUPAC name of 4,5-dimethyl-2,3-dihydro-1,4-thiazine 1,1-dioxide (CID 24975881) is 4,5-dimethyl-2,3-dihydro-1,4-thiazine 1,1-dioxide.
What is the SMILES notation for 4,5-dimethyl-2,3-dihydro-1,4-thiazine 1,1-dioxide?
The canonical SMILES for 4,5-dimethyl-2,3-dihydro-1,4-thiazine 1,1-dioxide is CC1=CS(=O)(=O)CCN1C.
What is the InChIKey of 4,5-dimethyl-2,3-dihydro-1,4-thiazine 1,1-dioxide?
The InChIKey is PZSBKLPUTYBREM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO2S/c1-6-5-10(8,9)4-3-7(6)2/h5H,3-4H2,1-2H3.
What are the key properties of 4,5-dimethyl-2,3-dihydro-1,4-thiazine 1,1-dioxide?
4,5-dimethyl-2,3-dihydro-1,4-thiazine 1,1-dioxide has a molecular weight of 161.23 g/mol, XLogP of 0.21, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-dimethyl-2,3-dihydro-1,4-thiazine 1,1-dioxide is sourced from PubChem (CID 24975881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).