(8Z)-2-cyclopent-3-en-1-yl-8-ethylidenethionane

C15H24S — CID 139372756

IUPAC(8Z)-2-cyclopent-3-en-1-yl-8-ethylidenethionane
SMILESC/C=C1/CCCCCC(C2CC=CC2)SC1
InChIInChI=1S/C15H24S/c1-2-13-8-4-3-5-11-15(16-12-13)14-9-6-7-10-14/h2,6-7,14-15H,3-5,8-12H2,1H3/b13-2-
InChIKeyYNKRPVHRQFAGMZ-SILLCRNTSA-N
MW236.42 g/mol
LogP4.96
Rot. Bonds1

About (8Z)-2-cyclopent-3-en-1-yl-8-ethylidenethionane

(8Z)-2-cyclopent-3-en-1-yl-8-ethylidenethionane (PubChem CID 139372756) has the molecular formula C15H24S and a molecular weight of 236.42 g/mol. Its IUPAC name is (8Z)-2-cyclopent-3-en-1-yl-8-ethylidenethionane.

Molecular Properties

Compound Name(8Z)-2-cyclopent-3-en-1-yl-8-ethylidenethionane
PubChem CID139372756
Molecular FormulaC15H24S
Molecular Weight236.42 g/mol
Exact Mass236.16
IUPAC Name(8Z)-2-cyclopent-3-en-1-yl-8-ethylidenethionane
SMILESC/C=C1/CCCCCC(C2CC=CC2)SC1
InChIInChI=1S/C15H24S/c1-2-13-8-4-3-5-11-15(16-12-13)14-9-6-7-10-14/h2,6-7,14-15H,3-5,8-12H2,1H3/b13-2-
InChIKeyYNKRPVHRQFAGMZ-SILLCRNTSA-N
XLogP4.96
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.42
LogP ≤ 54.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-Isopropyl-4-methyl-3,4-bis(methylthio)-1-cyclohexene
CID 375769
2-[(E)-1-fluorobut-2-enyl]-5-propan-2-ylthiolane
CID 178750855
3-Butyl-2-thiabicyclo[2.2.1]hept-5-ene
CID 13429919
5-Heptan-3-yl-2,3-dihydrothiophene
CID 100984300
3-Thiabicyclo[8,2,1]tridec-5-ene
CID 129779996
3-[(2R)-2,6-dimethylhept-5-enyl]-2-thiabicyclo[2.2.1]hept-5-ene
CID 134925316
(2R,3R,6R)-3-ethenyl-2-[(E)-pent-1-enyl]-6-propan-2-ylthiane
CID 134945755
5-(Trifluoromethyl)-1,2,3,4,5a,6,9,9a-octahydrodibenzothiophen-5-ium
CID 162565498
3-Ethylsulfanyl-3-methyl-6-propan-2-ylcyclohexene
CID 10559892
1-Ethylsulfanyl-3,7,11,15-tetramethylhexadec-2-ene
CID 54270450
5-[(E)-3,7,11,15-tetramethylhexadec-2-enyl]sulfanylcyclopenta-1,3-diene
CID 59671943
(E)-1-ethylsulfanyl-3,7,11,15-tetramethylhexadec-2-ene
CID 59671986

Frequently Asked Questions

What is the IUPAC name of (8Z)-2-cyclopent-3-en-1-yl-8-ethylidenethionane?
The IUPAC name of (8Z)-2-cyclopent-3-en-1-yl-8-ethylidenethionane (CID 139372756) is (8Z)-2-cyclopent-3-en-1-yl-8-ethylidenethionane.
What is the SMILES notation for (8Z)-2-cyclopent-3-en-1-yl-8-ethylidenethionane?
The canonical SMILES for (8Z)-2-cyclopent-3-en-1-yl-8-ethylidenethionane is C/C=C1/CCCCCC(C2CC=CC2)SC1.
What is the InChIKey of (8Z)-2-cyclopent-3-en-1-yl-8-ethylidenethionane?
The InChIKey is YNKRPVHRQFAGMZ-SILLCRNTSA-N. The full InChI is InChI=1S/C15H24S/c1-2-13-8-4-3-5-11-15(16-12-13)14-9-6-7-10-14/h2,6-7,14-15H,3-5,8-12H2,1H3/b13-2-.
What are the key properties of (8Z)-2-cyclopent-3-en-1-yl-8-ethylidenethionane?
(8Z)-2-cyclopent-3-en-1-yl-8-ethylidenethionane has a molecular weight of 236.42 g/mol, XLogP of 4.96, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (8Z)-2-cyclopent-3-en-1-yl-8-ethylidenethionane is sourced from PubChem (CID 139372756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).