2-methyl-4-(5-methylthiophen-3-yl)thiophene

C10H10S2 — CID 901476

IUPAC2-methyl-4-(5-methylthiophen-3-yl)thiophene
SMILESCc1cc(-c2csc(C)c2)cs1
InChIInChI=1S/C10H10S2/c1-7-3-9(5-11-7)10-4-8(2)12-6-10/h3-6H,1-2H3
InChIKeyBGFOQOAINPSCOG-UHFFFAOYSA-N
MW194.32 g/mol
LogP4.09
Rot. Bonds1

About 2-methyl-4-(5-methylthiophen-3-yl)thiophene

2-methyl-4-(5-methylthiophen-3-yl)thiophene (PubChem CID 901476) has the molecular formula C10H10S2 and a molecular weight of 194.32 g/mol. Its IUPAC name is 2-methyl-4-(5-methylthiophen-3-yl)thiophene.

Molecular Properties

Compound Name2-methyl-4-(5-methylthiophen-3-yl)thiophene
PubChem CID901476
Molecular FormulaC10H10S2
Molecular Weight194.32 g/mol
Exact Mass194.02
IUPAC Name2-methyl-4-(5-methylthiophen-3-yl)thiophene
SMILESCc1cc(-c2csc(C)c2)cs1
InChIInChI=1S/C10H10S2/c1-7-3-9(5-11-7)10-4-8(2)12-6-10/h3-6H,1-2H3
InChIKeyBGFOQOAINPSCOG-UHFFFAOYSA-N
XLogP4.09
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.32
LogP ≤ 54.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-(5-methylthiophen-3-yl)thiophene?
The IUPAC name of 2-methyl-4-(5-methylthiophen-3-yl)thiophene (CID 901476) is 2-methyl-4-(5-methylthiophen-3-yl)thiophene.
What is the SMILES notation for 2-methyl-4-(5-methylthiophen-3-yl)thiophene?
The canonical SMILES for 2-methyl-4-(5-methylthiophen-3-yl)thiophene is Cc1cc(-c2csc(C)c2)cs1.
What is the InChIKey of 2-methyl-4-(5-methylthiophen-3-yl)thiophene?
The InChIKey is BGFOQOAINPSCOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10S2/c1-7-3-9(5-11-7)10-4-8(2)12-6-10/h3-6H,1-2H3.
What are the key properties of 2-methyl-4-(5-methylthiophen-3-yl)thiophene?
2-methyl-4-(5-methylthiophen-3-yl)thiophene has a molecular weight of 194.32 g/mol, XLogP of 4.09, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-(5-methylthiophen-3-yl)thiophene is sourced from PubChem (CID 901476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).