2-methyl-3-(methylsulfanylmethylidene)pentane

C8H16S — CID 91083901

IUPAC2-methyl-3-(methylsulfanylmethylidene)pentane
SMILESCCC(=CSC)C(C)C
InChIInChI=1S/C8H16S/c1-5-8(6-9-4)7(2)3/h6-7H,5H2,1-4H3
InChIKeyVSOWYIZUKBVZFG-UHFFFAOYSA-N
MW144.28 g/mol
LogP3.30
Rot. Bonds3

About 2-methyl-3-(methylsulfanylmethylidene)pentane

2-methyl-3-(methylsulfanylmethylidene)pentane (PubChem CID 91083901) has the molecular formula C8H16S and a molecular weight of 144.28 g/mol. Its IUPAC name is 2-methyl-3-(methylsulfanylmethylidene)pentane.

Molecular Properties

Compound Name2-methyl-3-(methylsulfanylmethylidene)pentane
PubChem CID91083901
Molecular FormulaC8H16S
Molecular Weight144.28 g/mol
Exact Mass144.10
IUPAC Name2-methyl-3-(methylsulfanylmethylidene)pentane
SMILESCCC(=CSC)C(C)C
InChIInChI=1S/C8H16S/c1-5-8(6-9-4)7(2)3/h6-7H,5H2,1-4H3
InChIKeyVSOWYIZUKBVZFG-UHFFFAOYSA-N
XLogP3.30
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.28
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(methylsulfanylmethylidene)pentane?
The IUPAC name of 2-methyl-3-(methylsulfanylmethylidene)pentane (CID 91083901) is 2-methyl-3-(methylsulfanylmethylidene)pentane.
What is the SMILES notation for 2-methyl-3-(methylsulfanylmethylidene)pentane?
The canonical SMILES for 2-methyl-3-(methylsulfanylmethylidene)pentane is CCC(=CSC)C(C)C.
What is the InChIKey of 2-methyl-3-(methylsulfanylmethylidene)pentane?
The InChIKey is VSOWYIZUKBVZFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16S/c1-5-8(6-9-4)7(2)3/h6-7H,5H2,1-4H3.
What are the key properties of 2-methyl-3-(methylsulfanylmethylidene)pentane?
2-methyl-3-(methylsulfanylmethylidene)pentane has a molecular weight of 144.28 g/mol, XLogP of 3.30, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(methylsulfanylmethylidene)pentane is sourced from PubChem (CID 91083901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).