3-(4-fluoro-3-propan-2-ylphenyl)pyridine

C14H14FN — CID 83381583

IUPAC3-(4-fluoro-3-propan-2-ylphenyl)pyridine
SMILESCC(C)c1cc(-c2cccnc2)ccc1F
InChIInChI=1S/C14H14FN/c1-10(2)13-8-11(5-6-14(13)15)12-4-3-7-16-9-12/h3-10H,1-2H3
InChIKeyYFTSFYFKQIWJCF-UHFFFAOYSA-N
MW215.27 g/mol
LogP4.01
Rot. Bonds2

About 3-(4-fluoro-3-propan-2-ylphenyl)pyridine

3-(4-fluoro-3-propan-2-ylphenyl)pyridine (PubChem CID 83381583) has the molecular formula C14H14FN and a molecular weight of 215.27 g/mol. Its IUPAC name is 3-(4-fluoro-3-propan-2-ylphenyl)pyridine.

Molecular Properties

Compound Name3-(4-fluoro-3-propan-2-ylphenyl)pyridine
PubChem CID83381583
Molecular FormulaC14H14FN
Molecular Weight215.27 g/mol
Exact Mass215.11
IUPAC Name3-(4-fluoro-3-propan-2-ylphenyl)pyridine
SMILESCC(C)c1cc(-c2cccnc2)ccc1F
InChIInChI=1S/C14H14FN/c1-10(2)13-8-11(5-6-14(13)15)12-4-3-7-16-9-12/h3-10H,1-2H3
InChIKeyYFTSFYFKQIWJCF-UHFFFAOYSA-N
XLogP4.01
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.27
LogP ≤ 54.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-(4-fluoro-3-propan-2-ylphenyl)pyridine?
The IUPAC name of 3-(4-fluoro-3-propan-2-ylphenyl)pyridine (CID 83381583) is 3-(4-fluoro-3-propan-2-ylphenyl)pyridine.
What is the SMILES notation for 3-(4-fluoro-3-propan-2-ylphenyl)pyridine?
The canonical SMILES for 3-(4-fluoro-3-propan-2-ylphenyl)pyridine is CC(C)c1cc(-c2cccnc2)ccc1F.
What is the InChIKey of 3-(4-fluoro-3-propan-2-ylphenyl)pyridine?
The InChIKey is YFTSFYFKQIWJCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FN/c1-10(2)13-8-11(5-6-14(13)15)12-4-3-7-16-9-12/h3-10H,1-2H3.
What are the key properties of 3-(4-fluoro-3-propan-2-ylphenyl)pyridine?
3-(4-fluoro-3-propan-2-ylphenyl)pyridine has a molecular weight of 215.27 g/mol, XLogP of 4.01, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluoro-3-propan-2-ylphenyl)pyridine is sourced from PubChem (CID 83381583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).