methylsulfanylmethylidenecyclopentane

C7H12S — CID 15438650

IUPACmethylsulfanylmethylidenecyclopentane
SMILESCSC=C1CCCC1
InChIInChI=1S/C7H12S/c1-8-6-7-4-2-3-5-7/h6H,2-5H2,1H3
InChIKeyRJBPRUSGHKPEGO-UHFFFAOYSA-N
MW128.24 g/mol
LogP2.81
Rot. Bonds1

About methylsulfanylmethylidenecyclopentane

methylsulfanylmethylidenecyclopentane (PubChem CID 15438650) has the molecular formula C7H12S and a molecular weight of 128.24 g/mol. Its IUPAC name is methylsulfanylmethylidenecyclopentane.

Molecular Properties

Compound Namemethylsulfanylmethylidenecyclopentane
PubChem CID15438650
Molecular FormulaC7H12S
Molecular Weight128.24 g/mol
Exact Mass128.07
IUPAC Namemethylsulfanylmethylidenecyclopentane
SMILESCSC=C1CCCC1
InChIInChI=1S/C7H12S/c1-8-6-7-4-2-3-5-7/h6H,2-5H2,1H3
InChIKeyRJBPRUSGHKPEGO-UHFFFAOYSA-N
XLogP2.81
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.24
LogP ≤ 52.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of methylsulfanylmethylidenecyclopentane?
The IUPAC name of methylsulfanylmethylidenecyclopentane (CID 15438650) is methylsulfanylmethylidenecyclopentane.
What is the SMILES notation for methylsulfanylmethylidenecyclopentane?
The canonical SMILES for methylsulfanylmethylidenecyclopentane is CSC=C1CCCC1.
What is the InChIKey of methylsulfanylmethylidenecyclopentane?
The InChIKey is RJBPRUSGHKPEGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12S/c1-8-6-7-4-2-3-5-7/h6H,2-5H2,1H3.
What are the key properties of methylsulfanylmethylidenecyclopentane?
methylsulfanylmethylidenecyclopentane has a molecular weight of 128.24 g/mol, XLogP of 2.81, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methylsulfanylmethylidenecyclopentane is sourced from PubChem (CID 15438650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).