3-ethyl-2-fluoro-6-propylpyridine

C10H14FN — CID 121444063

IUPAC3-ethyl-2-fluoro-6-propylpyridine
SMILESCCCc1ccc(CC)c(F)n1
InChIInChI=1S/C10H14FN/c1-3-5-9-7-6-8(4-2)10(11)12-9/h6-7H,3-5H2,1-2H3
InChIKeyOFIZVXNVTOBKKG-UHFFFAOYSA-N
MW167.23 g/mol
LogP2.74
Rot. Bonds3

About 3-ethyl-2-fluoro-6-propylpyridine

3-ethyl-2-fluoro-6-propylpyridine (PubChem CID 121444063) has the molecular formula C10H14FN and a molecular weight of 167.23 g/mol. Its IUPAC name is 3-ethyl-2-fluoro-6-propylpyridine.

Molecular Properties

Compound Name3-ethyl-2-fluoro-6-propylpyridine
PubChem CID121444063
Molecular FormulaC10H14FN
Molecular Weight167.23 g/mol
Exact Mass167.11
IUPAC Name3-ethyl-2-fluoro-6-propylpyridine
SMILESCCCc1ccc(CC)c(F)n1
InChIInChI=1S/C10H14FN/c1-3-5-9-7-6-8(4-2)10(11)12-9/h6-7H,3-5H2,1-2H3
InChIKeyOFIZVXNVTOBKKG-UHFFFAOYSA-N
XLogP2.74
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.23
LogP ≤ 52.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-2-fluoro-6-propylpyridine?
The IUPAC name of 3-ethyl-2-fluoro-6-propylpyridine (CID 121444063) is 3-ethyl-2-fluoro-6-propylpyridine.
What is the SMILES notation for 3-ethyl-2-fluoro-6-propylpyridine?
The canonical SMILES for 3-ethyl-2-fluoro-6-propylpyridine is CCCc1ccc(CC)c(F)n1.
What is the InChIKey of 3-ethyl-2-fluoro-6-propylpyridine?
The InChIKey is OFIZVXNVTOBKKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14FN/c1-3-5-9-7-6-8(4-2)10(11)12-9/h6-7H,3-5H2,1-2H3.
What are the key properties of 3-ethyl-2-fluoro-6-propylpyridine?
3-ethyl-2-fluoro-6-propylpyridine has a molecular weight of 167.23 g/mol, XLogP of 2.74, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-2-fluoro-6-propylpyridine is sourced from PubChem (CID 121444063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).