3,4-dihydro-2H-thiazine 1,1-dioxide

C4H7NO2S — CID 58610118

IUPAC3,4-dihydro-2H-thiazine 1,1-dioxide
SMILESO=S1(=O)C=CCCN1
InChIInChI=1S/C4H7NO2S/c6-8(7)4-2-1-3-5-8/h2,4-5H,1,3H2
InChIKeyAWNXEELHEWXRTR-UHFFFAOYSA-N
MW133.17 g/mol
LogP-0.18
Rot. Bonds

About 3,4-dihydro-2H-thiazine 1,1-dioxide

3,4-dihydro-2H-thiazine 1,1-dioxide (PubChem CID 58610118) has the molecular formula C4H7NO2S and a molecular weight of 133.17 g/mol. Its IUPAC name is 3,4-dihydro-2H-thiazine 1,1-dioxide.

Molecular Properties

Compound Name3,4-dihydro-2H-thiazine 1,1-dioxide
PubChem CID58610118
Molecular FormulaC4H7NO2S
Molecular Weight133.17 g/mol
Exact Mass133.02
IUPAC Name3,4-dihydro-2H-thiazine 1,1-dioxide
SMILESO=S1(=O)C=CCCN1
InChIInChI=1S/C4H7NO2S/c6-8(7)4-2-1-3-5-8/h2,4-5H,1,3H2
InChIKeyAWNXEELHEWXRTR-UHFFFAOYSA-N
XLogP-0.18
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.17
LogP ≤ 5-0.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,4-dihydro-2H-thiazine 1,1-dioxide?
The IUPAC name of 3,4-dihydro-2H-thiazine 1,1-dioxide (CID 58610118) is 3,4-dihydro-2H-thiazine 1,1-dioxide.
What is the SMILES notation for 3,4-dihydro-2H-thiazine 1,1-dioxide?
The canonical SMILES for 3,4-dihydro-2H-thiazine 1,1-dioxide is O=S1(=O)C=CCCN1.
What is the InChIKey of 3,4-dihydro-2H-thiazine 1,1-dioxide?
The InChIKey is AWNXEELHEWXRTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7NO2S/c6-8(7)4-2-1-3-5-8/h2,4-5H,1,3H2.
What are the key properties of 3,4-dihydro-2H-thiazine 1,1-dioxide?
3,4-dihydro-2H-thiazine 1,1-dioxide has a molecular weight of 133.17 g/mol, XLogP of -0.18, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dihydro-2H-thiazine 1,1-dioxide is sourced from PubChem (CID 58610118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).