4-(4-methylcyclohexyl)-1,4-thiazinane 1-oxide

C11H21NOS — CID 20761842

IUPAC4-(4-methylcyclohexyl)-1,4-thiazinane 1-oxide
SMILESCC1CCC(N2CCS(=O)CC2)CC1
InChIInChI=1S/C11H21NOS/c1-10-2-4-11(5-3-10)12-6-8-14(13)9-7-12/h10-11H,2-9H2,1H3
InChIKeyWNQXJSLSLKPHDL-UHFFFAOYSA-N
MW215.36 g/mol
LogP1.63
Rot. Bonds1

About 4-(4-methylcyclohexyl)-1,4-thiazinane 1-oxide

4-(4-methylcyclohexyl)-1,4-thiazinane 1-oxide (PubChem CID 20761842) has the molecular formula C11H21NOS and a molecular weight of 215.36 g/mol. Its IUPAC name is 4-(4-methylcyclohexyl)-1,4-thiazinane 1-oxide.

Molecular Properties

Compound Name4-(4-methylcyclohexyl)-1,4-thiazinane 1-oxide
PubChem CID20761842
Molecular FormulaC11H21NOS
Molecular Weight215.36 g/mol
Exact Mass215.13
IUPAC Name4-(4-methylcyclohexyl)-1,4-thiazinane 1-oxide
SMILESCC1CCC(N2CCS(=O)CC2)CC1
InChIInChI=1S/C11H21NOS/c1-10-2-4-11(5-3-10)12-6-8-14(13)9-7-12/h10-11H,2-9H2,1H3
InChIKeyWNQXJSLSLKPHDL-UHFFFAOYSA-N
XLogP1.63
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.36
LogP ≤ 51.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(4-methylcyclohexyl)-1,4-thiazinane 1-oxide?
The IUPAC name of 4-(4-methylcyclohexyl)-1,4-thiazinane 1-oxide (CID 20761842) is 4-(4-methylcyclohexyl)-1,4-thiazinane 1-oxide.
What is the SMILES notation for 4-(4-methylcyclohexyl)-1,4-thiazinane 1-oxide?
The canonical SMILES for 4-(4-methylcyclohexyl)-1,4-thiazinane 1-oxide is CC1CCC(N2CCS(=O)CC2)CC1.
What is the InChIKey of 4-(4-methylcyclohexyl)-1,4-thiazinane 1-oxide?
The InChIKey is WNQXJSLSLKPHDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NOS/c1-10-2-4-11(5-3-10)12-6-8-14(13)9-7-12/h10-11H,2-9H2,1H3.
What are the key properties of 4-(4-methylcyclohexyl)-1,4-thiazinane 1-oxide?
4-(4-methylcyclohexyl)-1,4-thiazinane 1-oxide has a molecular weight of 215.36 g/mol, XLogP of 1.63, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methylcyclohexyl)-1,4-thiazinane 1-oxide is sourced from PubChem (CID 20761842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).