6-fluorothiazinane 1,1-dioxide

C4H8FNO2S — CID 86702146

IUPAC6-fluorothiazinane 1,1-dioxide
SMILESO=S1(=O)NCCCC1F
InChIInChI=1S/C4H8FNO2S/c5-4-2-1-3-6-9(4,7)8/h4,6H,1-3H2
InChIKeyLCLGLNQHQHYEAZ-UHFFFAOYSA-N
MW153.18 g/mol
LogP-0.00
Rot. Bonds

About 6-fluorothiazinane 1,1-dioxide

6-fluorothiazinane 1,1-dioxide (PubChem CID 86702146) has the molecular formula C4H8FNO2S and a molecular weight of 153.18 g/mol. Its IUPAC name is 6-fluorothiazinane 1,1-dioxide.

Molecular Properties

Compound Name6-fluorothiazinane 1,1-dioxide
PubChem CID86702146
Molecular FormulaC4H8FNO2S
Molecular Weight153.18 g/mol
Exact Mass153.03
IUPAC Name6-fluorothiazinane 1,1-dioxide
SMILESO=S1(=O)NCCCC1F
InChIInChI=1S/C4H8FNO2S/c5-4-2-1-3-6-9(4,7)8/h4,6H,1-3H2
InChIKeyLCLGLNQHQHYEAZ-UHFFFAOYSA-N
XLogP-0.00
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.18
LogP ≤ 5-0.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-fluorothiazinane 1,1-dioxide?
The IUPAC name of 6-fluorothiazinane 1,1-dioxide (CID 86702146) is 6-fluorothiazinane 1,1-dioxide.
What is the SMILES notation for 6-fluorothiazinane 1,1-dioxide?
The canonical SMILES for 6-fluorothiazinane 1,1-dioxide is O=S1(=O)NCCCC1F.
What is the InChIKey of 6-fluorothiazinane 1,1-dioxide?
The InChIKey is LCLGLNQHQHYEAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8FNO2S/c5-4-2-1-3-6-9(4,7)8/h4,6H,1-3H2.
What are the key properties of 6-fluorothiazinane 1,1-dioxide?
6-fluorothiazinane 1,1-dioxide has a molecular weight of 153.18 g/mol, XLogP of -0.00, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluorothiazinane 1,1-dioxide is sourced from PubChem (CID 86702146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).