6-ethyl-4-(furan-2-yl)-2,3-dimethylpyridine

C13H15NO — CID 608303

IUPAC6-ethyl-4-(furan-2-yl)-2,3-dimethylpyridine
SMILESCCc1cc(-c2ccco2)c(C)c(C)n1
InChIInChI=1S/C13H15NO/c1-4-11-8-12(9(2)10(3)14-11)13-6-5-7-15-13/h5-8H,4H2,1-3H3
InChIKeyDIWASMZWNWOPMD-UHFFFAOYSA-N
MW201.27 g/mol
LogP3.52
Rot. Bonds2

About 6-ethyl-4-(furan-2-yl)-2,3-dimethylpyridine

6-ethyl-4-(furan-2-yl)-2,3-dimethylpyridine (PubChem CID 608303) has the molecular formula C13H15NO and a molecular weight of 201.27 g/mol. Its IUPAC name is 6-ethyl-4-(furan-2-yl)-2,3-dimethylpyridine.

Molecular Properties

Compound Name6-ethyl-4-(furan-2-yl)-2,3-dimethylpyridine
PubChem CID608303
Molecular FormulaC13H15NO
Molecular Weight201.27 g/mol
Exact Mass201.12
IUPAC Name6-ethyl-4-(furan-2-yl)-2,3-dimethylpyridine
SMILESCCc1cc(-c2ccco2)c(C)c(C)n1
InChIInChI=1S/C13H15NO/c1-4-11-8-12(9(2)10(3)14-11)13-6-5-7-15-13/h5-8H,4H2,1-3H3
InChIKeyDIWASMZWNWOPMD-UHFFFAOYSA-N
XLogP3.52
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 53.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-ethyl-4-(furan-2-yl)-2,3-dimethylpyridine?
The IUPAC name of 6-ethyl-4-(furan-2-yl)-2,3-dimethylpyridine (CID 608303) is 6-ethyl-4-(furan-2-yl)-2,3-dimethylpyridine.
What is the SMILES notation for 6-ethyl-4-(furan-2-yl)-2,3-dimethylpyridine?
The canonical SMILES for 6-ethyl-4-(furan-2-yl)-2,3-dimethylpyridine is CCc1cc(-c2ccco2)c(C)c(C)n1.
What is the InChIKey of 6-ethyl-4-(furan-2-yl)-2,3-dimethylpyridine?
The InChIKey is DIWASMZWNWOPMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO/c1-4-11-8-12(9(2)10(3)14-11)13-6-5-7-15-13/h5-8H,4H2,1-3H3.
What are the key properties of 6-ethyl-4-(furan-2-yl)-2,3-dimethylpyridine?
6-ethyl-4-(furan-2-yl)-2,3-dimethylpyridine has a molecular weight of 201.27 g/mol, XLogP of 3.52, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-4-(furan-2-yl)-2,3-dimethylpyridine is sourced from PubChem (CID 608303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).