[(R)-methylsulfinyl]cyclohexane

C7H14OS — CID 11029980

IUPAC[(R)-methylsulfinyl]cyclohexane
SMILESC[S@@](=O)C1CCCCC1
InChIInChI=1S/C7H14OS/c1-9(8)7-5-3-2-4-6-7/h7H,2-6H2,1H3/t9-/m1/s1
InChIKeyISJDYHYHRZQRKW-SECBINFHSA-N
MW146.25 g/mol
LogP1.70
Rot. Bonds1

About [(R)-methylsulfinyl]cyclohexane

[(R)-methylsulfinyl]cyclohexane (PubChem CID 11029980) has the molecular formula C7H14OS and a molecular weight of 146.25 g/mol. Its IUPAC name is [(R)-methylsulfinyl]cyclohexane.

Molecular Properties

Compound Name[(R)-methylsulfinyl]cyclohexane
PubChem CID11029980
Molecular FormulaC7H14OS
Molecular Weight146.25 g/mol
Exact Mass146.08
IUPAC Name[(R)-methylsulfinyl]cyclohexane
SMILESC[S@@](=O)C1CCCCC1
InChIInChI=1S/C7H14OS/c1-9(8)7-5-3-2-4-6-7/h7H,2-6H2,1H3/t9-/m1/s1
InChIKeyISJDYHYHRZQRKW-SECBINFHSA-N
XLogP1.70
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.25
LogP ≤ 51.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of [(R)-methylsulfinyl]cyclohexane?
The IUPAC name of [(R)-methylsulfinyl]cyclohexane (CID 11029980) is [(R)-methylsulfinyl]cyclohexane.
What is the SMILES notation for [(R)-methylsulfinyl]cyclohexane?
The canonical SMILES for [(R)-methylsulfinyl]cyclohexane is C[S@@](=O)C1CCCCC1.
What is the InChIKey of [(R)-methylsulfinyl]cyclohexane?
The InChIKey is ISJDYHYHRZQRKW-SECBINFHSA-N. The full InChI is InChI=1S/C7H14OS/c1-9(8)7-5-3-2-4-6-7/h7H,2-6H2,1H3/t9-/m1/s1.
What are the key properties of [(R)-methylsulfinyl]cyclohexane?
[(R)-methylsulfinyl]cyclohexane has a molecular weight of 146.25 g/mol, XLogP of 1.70, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(R)-methylsulfinyl]cyclohexane is sourced from PubChem (CID 11029980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).