2-methyl-6-[(E)-2-thiophen-2-ylethenyl]pyridine

C12H11NS — CID 18763213

IUPAC2-methyl-6-[(E)-2-thiophen-2-ylethenyl]pyridine
SMILESCc1cccc(/C=C/c2cccs2)n1
InChIInChI=1S/C12H11NS/c1-10-4-2-5-11(13-10)7-8-12-6-3-9-14-12/h2-9H,1H3/b8-7+
InChIKeyVCABWIQGYHBMHS-BQYQJAHWSA-N
MW201.29 g/mol
LogP3.62
Rot. Bonds2

About 2-methyl-6-[(E)-2-thiophen-2-ylethenyl]pyridine

2-methyl-6-[(E)-2-thiophen-2-ylethenyl]pyridine (PubChem CID 18763213) has the molecular formula C12H11NS and a molecular weight of 201.29 g/mol. Its IUPAC name is 2-methyl-6-[(E)-2-thiophen-2-ylethenyl]pyridine.

Molecular Properties

Compound Name2-methyl-6-[(E)-2-thiophen-2-ylethenyl]pyridine
PubChem CID18763213
Molecular FormulaC12H11NS
Molecular Weight201.29 g/mol
Exact Mass201.06
IUPAC Name2-methyl-6-[(E)-2-thiophen-2-ylethenyl]pyridine
SMILESCc1cccc(/C=C/c2cccs2)n1
InChIInChI=1S/C12H11NS/c1-10-4-2-5-11(13-10)7-8-12-6-3-9-14-12/h2-9H,1H3/b8-7+
InChIKeyVCABWIQGYHBMHS-BQYQJAHWSA-N
XLogP3.62
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.29
LogP ≤ 53.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-[(E)-2-thiophen-2-ylethenyl]pyridine?
The IUPAC name of 2-methyl-6-[(E)-2-thiophen-2-ylethenyl]pyridine (CID 18763213) is 2-methyl-6-[(E)-2-thiophen-2-ylethenyl]pyridine.
What is the SMILES notation for 2-methyl-6-[(E)-2-thiophen-2-ylethenyl]pyridine?
The canonical SMILES for 2-methyl-6-[(E)-2-thiophen-2-ylethenyl]pyridine is Cc1cccc(/C=C/c2cccs2)n1.
What is the InChIKey of 2-methyl-6-[(E)-2-thiophen-2-ylethenyl]pyridine?
The InChIKey is VCABWIQGYHBMHS-BQYQJAHWSA-N. The full InChI is InChI=1S/C12H11NS/c1-10-4-2-5-11(13-10)7-8-12-6-3-9-14-12/h2-9H,1H3/b8-7+.
What are the key properties of 2-methyl-6-[(E)-2-thiophen-2-ylethenyl]pyridine?
2-methyl-6-[(E)-2-thiophen-2-ylethenyl]pyridine has a molecular weight of 201.29 g/mol, XLogP of 3.62, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-[(E)-2-thiophen-2-ylethenyl]pyridine is sourced from PubChem (CID 18763213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).