3-cyclopentylpentan-3-ol;sulfane

C10H22OS — CID 160773111

IUPAC3-cyclopentylpentan-3-ol;sulfane
SMILESCCC(O)(CC)C1CCCC1.S
InChIInChI=1S/C10H20O.H2S/c1-3-10(11,4-2)9-7-5-6-8-9;/h9,11H,3-8H2,1-2H3;1H2
InChIKeyRZOTUWJKAMSASI-UHFFFAOYSA-N
MW190.35 g/mol
LogP2.84
Rot. Bonds3

About 3-cyclopentylpentan-3-ol;sulfane

3-cyclopentylpentan-3-ol;sulfane (PubChem CID 160773111) has the molecular formula C10H22OS and a molecular weight of 190.35 g/mol. Its IUPAC name is 3-cyclopentylpentan-3-ol;sulfane.

Molecular Properties

Compound Name3-cyclopentylpentan-3-ol;sulfane
PubChem CID160773111
Molecular FormulaC10H22OS
Molecular Weight190.35 g/mol
Exact Mass190.14
IUPAC Name3-cyclopentylpentan-3-ol;sulfane
SMILESCCC(O)(CC)C1CCCC1.S
InChIInChI=1S/C10H20O.H2S/c1-3-10(11,4-2)9-7-5-6-8-9;/h9,11H,3-8H2,1-2H3;1H2
InChIKeyRZOTUWJKAMSASI-UHFFFAOYSA-N
XLogP2.84
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.35
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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2-cyclohexylpropane-1,2,3-triol
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tert-butyl (2S)-2-(3-hydroxypentan-3-yl)pyrrolidine-1-carboxylate;3-cyclopentylpentan-3-ol;methane;sulfane
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Frequently Asked Questions

What is the IUPAC name of 3-cyclopentylpentan-3-ol;sulfane?
The IUPAC name of 3-cyclopentylpentan-3-ol;sulfane (CID 160773111) is 3-cyclopentylpentan-3-ol;sulfane.
What is the SMILES notation for 3-cyclopentylpentan-3-ol;sulfane?
The canonical SMILES for 3-cyclopentylpentan-3-ol;sulfane is CCC(O)(CC)C1CCCC1.S.
What is the InChIKey of 3-cyclopentylpentan-3-ol;sulfane?
The InChIKey is RZOTUWJKAMSASI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O.H2S/c1-3-10(11,4-2)9-7-5-6-8-9;/h9,11H,3-8H2,1-2H3;1H2.
What are the key properties of 3-cyclopentylpentan-3-ol;sulfane?
3-cyclopentylpentan-3-ol;sulfane has a molecular weight of 190.35 g/mol, XLogP of 2.84, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentylpentan-3-ol;sulfane is sourced from PubChem (CID 160773111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).