2-(methylsulfanylmethyl)thiophene

C6H8S2 — CID 12872111

IUPAC2-(methylsulfanylmethyl)thiophene
SMILESCSCc1cccs1
InChIInChI=1S/C6H8S2/c1-7-5-6-3-2-4-8-6/h2-4H,5H2,1H3
InChIKeySXBFKTWZWIHXOY-UHFFFAOYSA-N
MW144.26 g/mol
LogP2.61
Rot. Bonds2

About 2-(methylsulfanylmethyl)thiophene

2-(methylsulfanylmethyl)thiophene (PubChem CID 12872111) has the molecular formula C6H8S2 and a molecular weight of 144.26 g/mol. Its IUPAC name is 2-(methylsulfanylmethyl)thiophene.

Molecular Properties

Compound Name2-(methylsulfanylmethyl)thiophene
PubChem CID12872111
Molecular FormulaC6H8S2
Molecular Weight144.26 g/mol
Exact Mass144.01
IUPAC Name2-(methylsulfanylmethyl)thiophene
SMILESCSCc1cccs1
InChIInChI=1S/C6H8S2/c1-7-5-6-3-2-4-8-6/h2-4H,5H2,1H3
InChIKeySXBFKTWZWIHXOY-UHFFFAOYSA-N
XLogP2.61
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.26
LogP ≤ 52.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(ethenylsulfanylmethyl)thiophene
CID 19076101
1-(thiophen-2-ylmethylsulfanyl)propan-2-amine
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2-[(4-methylphenyl)methylsulfanylmethyl]thiophene
CID 5159898
2-(thiophen-2-ylmethylsulfanyl)ethylazanium
CID 7129022
N-methyl-2-methylsulfanyl-N-(thiophen-2-ylmethyl)ethanamine
CID 123818114
4-(methylsulfanylmethyl)-N-(thiophen-2-ylmethyl)pyridin-2-amine
CID 71968208
2-(thiophen-2-ylmethylsulfanyl)-1,3-thiazole
CID 130628845
2-(cyclopentylsulfanylmethyl)thiophene
CID 130677399
2-(bromomethyl)thiophene
CID 11829978
2-(methoxymethyl)thiophene
CID 10240820
N-methyl-2-(thiophen-2-ylmethylsulfanyl)acetamide
CID 60645758
2-[[(E)-3-bromoprop-2-enyl]sulfanylmethyl]thiophene
CID 10514737

Frequently Asked Questions

What is the IUPAC name of 2-(methylsulfanylmethyl)thiophene?
The IUPAC name of 2-(methylsulfanylmethyl)thiophene (CID 12872111) is 2-(methylsulfanylmethyl)thiophene.
What is the SMILES notation for 2-(methylsulfanylmethyl)thiophene?
The canonical SMILES for 2-(methylsulfanylmethyl)thiophene is CSCc1cccs1.
What is the InChIKey of 2-(methylsulfanylmethyl)thiophene?
The InChIKey is SXBFKTWZWIHXOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8S2/c1-7-5-6-3-2-4-8-6/h2-4H,5H2,1H3.
What are the key properties of 2-(methylsulfanylmethyl)thiophene?
2-(methylsulfanylmethyl)thiophene has a molecular weight of 144.26 g/mol, XLogP of 2.61, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylsulfanylmethyl)thiophene is sourced from PubChem (CID 12872111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).