5-ethoxy-1-(2-fluorophenyl)-2-methyl-2H-pyridine

C14H16FNO — CID 156754613

IUPAC5-ethoxy-1-(2-fluorophenyl)-2-methyl-2H-pyridine
SMILESCCOC1=CN(c2ccccc2F)C(C)C=C1
InChIInChI=1S/C14H16FNO/c1-3-17-12-9-8-11(2)16(10-12)14-7-5-4-6-13(14)15/h4-11H,3H2,1-2H3
InChIKeyZPQHZXKIHANKJZ-UHFFFAOYSA-N
MW233.29 g/mol
LogP3.47
Rot. Bonds3

About 5-ethoxy-1-(2-fluorophenyl)-2-methyl-2H-pyridine

5-ethoxy-1-(2-fluorophenyl)-2-methyl-2H-pyridine (PubChem CID 156754613) has the molecular formula C14H16FNO and a molecular weight of 233.29 g/mol. Its IUPAC name is 5-ethoxy-1-(2-fluorophenyl)-2-methyl-2H-pyridine.

Molecular Properties

Compound Name5-ethoxy-1-(2-fluorophenyl)-2-methyl-2H-pyridine
PubChem CID156754613
Molecular FormulaC14H16FNO
Molecular Weight233.29 g/mol
Exact Mass233.12
IUPAC Name5-ethoxy-1-(2-fluorophenyl)-2-methyl-2H-pyridine
SMILESCCOC1=CN(c2ccccc2F)C(C)C=C1
InChIInChI=1S/C14H16FNO/c1-3-17-12-9-8-11(2)16(10-12)14-7-5-4-6-13(14)15/h4-11H,3H2,1-2H3
InChIKeyZPQHZXKIHANKJZ-UHFFFAOYSA-N
XLogP3.47
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.29
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-ethoxy-1-(2-fluorophenyl)-2-methyl-2H-pyridine?
The IUPAC name of 5-ethoxy-1-(2-fluorophenyl)-2-methyl-2H-pyridine (CID 156754613) is 5-ethoxy-1-(2-fluorophenyl)-2-methyl-2H-pyridine.
What is the SMILES notation for 5-ethoxy-1-(2-fluorophenyl)-2-methyl-2H-pyridine?
The canonical SMILES for 5-ethoxy-1-(2-fluorophenyl)-2-methyl-2H-pyridine is CCOC1=CN(c2ccccc2F)C(C)C=C1.
What is the InChIKey of 5-ethoxy-1-(2-fluorophenyl)-2-methyl-2H-pyridine?
The InChIKey is ZPQHZXKIHANKJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16FNO/c1-3-17-12-9-8-11(2)16(10-12)14-7-5-4-6-13(14)15/h4-11H,3H2,1-2H3.
What are the key properties of 5-ethoxy-1-(2-fluorophenyl)-2-methyl-2H-pyridine?
5-ethoxy-1-(2-fluorophenyl)-2-methyl-2H-pyridine has a molecular weight of 233.29 g/mol, XLogP of 3.47, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethoxy-1-(2-fluorophenyl)-2-methyl-2H-pyridine is sourced from PubChem (CID 156754613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).