3-(3-fluorophenyl)-2-propan-2-ylpyridine

C14H14FN — CID 90162322

IUPAC3-(3-fluorophenyl)-2-propan-2-ylpyridine
SMILESCC(C)c1ncccc1-c1cccc(F)c1
InChIInChI=1S/C14H14FN/c1-10(2)14-13(7-4-8-16-14)11-5-3-6-12(15)9-11/h3-10H,1-2H3
InChIKeyUHHDZQFYEQIOQQ-UHFFFAOYSA-N
MW215.27 g/mol
LogP4.01
Rot. Bonds2

About 3-(3-fluorophenyl)-2-propan-2-ylpyridine

3-(3-fluorophenyl)-2-propan-2-ylpyridine (PubChem CID 90162322) has the molecular formula C14H14FN and a molecular weight of 215.27 g/mol. Its IUPAC name is 3-(3-fluorophenyl)-2-propan-2-ylpyridine.

Molecular Properties

Compound Name3-(3-fluorophenyl)-2-propan-2-ylpyridine
PubChem CID90162322
Molecular FormulaC14H14FN
Molecular Weight215.27 g/mol
Exact Mass215.11
IUPAC Name3-(3-fluorophenyl)-2-propan-2-ylpyridine
SMILESCC(C)c1ncccc1-c1cccc(F)c1
InChIInChI=1S/C14H14FN/c1-10(2)14-13(7-4-8-16-14)11-5-3-6-12(15)9-11/h3-10H,1-2H3
InChIKeyUHHDZQFYEQIOQQ-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-(3-fluorophenyl)-2-propan-2-ylpyridine?
The IUPAC name of 3-(3-fluorophenyl)-2-propan-2-ylpyridine (CID 90162322) is 3-(3-fluorophenyl)-2-propan-2-ylpyridine.
What is the SMILES notation for 3-(3-fluorophenyl)-2-propan-2-ylpyridine?
The canonical SMILES for 3-(3-fluorophenyl)-2-propan-2-ylpyridine is CC(C)c1ncccc1-c1cccc(F)c1.
What is the InChIKey of 3-(3-fluorophenyl)-2-propan-2-ylpyridine?
The InChIKey is UHHDZQFYEQIOQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FN/c1-10(2)14-13(7-4-8-16-14)11-5-3-6-12(15)9-11/h3-10H,1-2H3.
What are the key properties of 3-(3-fluorophenyl)-2-propan-2-ylpyridine?
3-(3-fluorophenyl)-2-propan-2-ylpyridine 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-(3-fluorophenyl)-2-propan-2-ylpyridine is sourced from PubChem (CID 90162322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).