(cyclopentyldisulfanyl)methylcyclopentane

C11H20S2 — CID 129169499

IUPAC(cyclopentyldisulfanyl)methylcyclopentane
SMILESC1CCC(CSSC2CCCC2)C1
InChIInChI=1S/C11H20S2/c1-2-6-10(5-1)9-12-13-11-7-3-4-8-11/h10-11H,1-9H2
InChIKeyDWXXBKUBWKASJS-UHFFFAOYSA-N
MW216.41 g/mol
LogP4.50
Rot. Bonds4

About (cyclopentyldisulfanyl)methylcyclopentane

(cyclopentyldisulfanyl)methylcyclopentane (PubChem CID 129169499) has the molecular formula C11H20S2 and a molecular weight of 216.41 g/mol. Its IUPAC name is (cyclopentyldisulfanyl)methylcyclopentane.

Molecular Properties

Compound Name(cyclopentyldisulfanyl)methylcyclopentane
PubChem CID129169499
Molecular FormulaC11H20S2
Molecular Weight216.41 g/mol
Exact Mass216.10
IUPAC Name(cyclopentyldisulfanyl)methylcyclopentane
SMILESC1CCC(CSSC2CCCC2)C1
InChIInChI=1S/C11H20S2/c1-2-6-10(5-1)9-12-13-11-7-3-4-8-11/h10-11H,1-9H2
InChIKeyDWXXBKUBWKASJS-UHFFFAOYSA-N
XLogP4.50
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.41
LogP ≤ 54.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'disulphide', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (cyclopentyldisulfanyl)methylcyclopentane?
The IUPAC name of (cyclopentyldisulfanyl)methylcyclopentane (CID 129169499) is (cyclopentyldisulfanyl)methylcyclopentane.
What is the SMILES notation for (cyclopentyldisulfanyl)methylcyclopentane?
The canonical SMILES for (cyclopentyldisulfanyl)methylcyclopentane is C1CCC(CSSC2CCCC2)C1.
What is the InChIKey of (cyclopentyldisulfanyl)methylcyclopentane?
The InChIKey is DWXXBKUBWKASJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20S2/c1-2-6-10(5-1)9-12-13-11-7-3-4-8-11/h10-11H,1-9H2.
What are the key properties of (cyclopentyldisulfanyl)methylcyclopentane?
(cyclopentyldisulfanyl)methylcyclopentane has a molecular weight of 216.41 g/mol, XLogP of 4.50, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (cyclopentyldisulfanyl)methylcyclopentane is sourced from PubChem (CID 129169499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).