5-ethyl-2-(2-fluoro-4-methoxyphenyl)pyridine

C14H14FNO — CID 19101283

IUPAC5-ethyl-2-(2-fluoro-4-methoxyphenyl)pyridine
SMILESCCc1ccc(-c2ccc(OC)cc2F)nc1
InChIInChI=1S/C14H14FNO/c1-3-10-4-7-14(16-9-10)12-6-5-11(17-2)8-13(12)15/h4-9H,3H2,1-2H3
InChIKeyWZPDMRVBSCZNBK-UHFFFAOYSA-N
MW231.27 g/mol
LogP3.46
Rot. Bonds3

About 5-ethyl-2-(2-fluoro-4-methoxyphenyl)pyridine

5-ethyl-2-(2-fluoro-4-methoxyphenyl)pyridine (PubChem CID 19101283) has the molecular formula C14H14FNO and a molecular weight of 231.27 g/mol. Its IUPAC name is 5-ethyl-2-(2-fluoro-4-methoxyphenyl)pyridine.

Molecular Properties

Compound Name5-ethyl-2-(2-fluoro-4-methoxyphenyl)pyridine
PubChem CID19101283
Molecular FormulaC14H14FNO
Molecular Weight231.27 g/mol
Exact Mass231.11
IUPAC Name5-ethyl-2-(2-fluoro-4-methoxyphenyl)pyridine
SMILESCCc1ccc(-c2ccc(OC)cc2F)nc1
InChIInChI=1S/C14H14FNO/c1-3-10-4-7-14(16-9-10)12-6-5-11(17-2)8-13(12)15/h4-9H,3H2,1-2H3
InChIKeyWZPDMRVBSCZNBK-UHFFFAOYSA-N
XLogP3.46
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.27
LogP ≤ 53.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-2-(2-fluoro-4-methoxyphenyl)pyridine?
The IUPAC name of 5-ethyl-2-(2-fluoro-4-methoxyphenyl)pyridine (CID 19101283) is 5-ethyl-2-(2-fluoro-4-methoxyphenyl)pyridine.
What is the SMILES notation for 5-ethyl-2-(2-fluoro-4-methoxyphenyl)pyridine?
The canonical SMILES for 5-ethyl-2-(2-fluoro-4-methoxyphenyl)pyridine is CCc1ccc(-c2ccc(OC)cc2F)nc1.
What is the InChIKey of 5-ethyl-2-(2-fluoro-4-methoxyphenyl)pyridine?
The InChIKey is WZPDMRVBSCZNBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FNO/c1-3-10-4-7-14(16-9-10)12-6-5-11(17-2)8-13(12)15/h4-9H,3H2,1-2H3.
What are the key properties of 5-ethyl-2-(2-fluoro-4-methoxyphenyl)pyridine?
5-ethyl-2-(2-fluoro-4-methoxyphenyl)pyridine has a molecular weight of 231.27 g/mol, XLogP of 3.46, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2-(2-fluoro-4-methoxyphenyl)pyridine is sourced from PubChem (CID 19101283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).