2-fluoro-4-methoxy-5-nonan-3-ylpyridine

C15H24FNO — CID 139376349

IUPAC2-fluoro-4-methoxy-5-nonan-3-ylpyridine
SMILESCCCCCCC(CC)c1cnc(F)cc1OC
InChIInChI=1S/C15H24FNO/c1-4-6-7-8-9-12(5-2)13-11-17-15(16)10-14(13)18-3/h10-12H,4-9H2,1-3H3
InChIKeyRHIRGZHUEJEJIH-UHFFFAOYSA-N
MW253.36 g/mol
LogP4.69
Rot. Bonds8

About 2-fluoro-4-methoxy-5-nonan-3-ylpyridine

2-fluoro-4-methoxy-5-nonan-3-ylpyridine (PubChem CID 139376349) has the molecular formula C15H24FNO and a molecular weight of 253.36 g/mol. Its IUPAC name is 2-fluoro-4-methoxy-5-nonan-3-ylpyridine.

Molecular Properties

Compound Name2-fluoro-4-methoxy-5-nonan-3-ylpyridine
PubChem CID139376349
Molecular FormulaC15H24FNO
Molecular Weight253.36 g/mol
Exact Mass253.18
IUPAC Name2-fluoro-4-methoxy-5-nonan-3-ylpyridine
SMILESCCCCCCC(CC)c1cnc(F)cc1OC
InChIInChI=1S/C15H24FNO/c1-4-6-7-8-9-12(5-2)13-11-17-15(16)10-14(13)18-3/h10-12H,4-9H2,1-3H3
InChIKeyRHIRGZHUEJEJIH-UHFFFAOYSA-N
XLogP4.69
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.36
LogP ≤ 54.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-4-methoxy-5-nonan-3-ylpyridine?
The IUPAC name of 2-fluoro-4-methoxy-5-nonan-3-ylpyridine (CID 139376349) is 2-fluoro-4-methoxy-5-nonan-3-ylpyridine.
What is the SMILES notation for 2-fluoro-4-methoxy-5-nonan-3-ylpyridine?
The canonical SMILES for 2-fluoro-4-methoxy-5-nonan-3-ylpyridine is CCCCCCC(CC)c1cnc(F)cc1OC.
What is the InChIKey of 2-fluoro-4-methoxy-5-nonan-3-ylpyridine?
The InChIKey is RHIRGZHUEJEJIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24FNO/c1-4-6-7-8-9-12(5-2)13-11-17-15(16)10-14(13)18-3/h10-12H,4-9H2,1-3H3.
What are the key properties of 2-fluoro-4-methoxy-5-nonan-3-ylpyridine?
2-fluoro-4-methoxy-5-nonan-3-ylpyridine has a molecular weight of 253.36 g/mol, XLogP of 4.69, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-4-methoxy-5-nonan-3-ylpyridine is sourced from PubChem (CID 139376349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).