2-fluoro-5-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pyridine

C11H16FNO2 — CID 112592625

IUPAC2-fluoro-5-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pyridine
SMILESCC(C)(C)OCCOc1ccc(F)nc1
InChIInChI=1S/C11H16FNO2/c1-11(2,3)15-7-6-14-9-4-5-10(12)13-8-9/h4-5,8H,6-7H2,1-3H3
InChIKeyANCYAWUQEPUASE-UHFFFAOYSA-N
MW213.25 g/mol
LogP2.41
Rot. Bonds4

About 2-fluoro-5-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pyridine

2-fluoro-5-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pyridine (PubChem CID 112592625) has the molecular formula C11H16FNO2 and a molecular weight of 213.25 g/mol. Its IUPAC name is 2-fluoro-5-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pyridine.

Molecular Properties

Compound Name2-fluoro-5-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pyridine
PubChem CID112592625
Molecular FormulaC11H16FNO2
Molecular Weight213.25 g/mol
Exact Mass213.12
IUPAC Name2-fluoro-5-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pyridine
SMILESCC(C)(C)OCCOc1ccc(F)nc1
InChIInChI=1S/C11H16FNO2/c1-11(2,3)15-7-6-14-9-4-5-10(12)13-8-9/h4-5,8H,6-7H2,1-3H3
InChIKeyANCYAWUQEPUASE-UHFFFAOYSA-N
XLogP2.41
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.25
LogP ≤ 52.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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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Related Compounds

1-[5-[2-[(2-methylpropan-2-yl)oxy]ethoxy]-2-pyridinyl]ethanone
CID 112587862
2-fluoro-5-hexoxypyridine
CID 115371648
2-fluoro-5-[2-(2-methylpropoxy)ethoxy]pyridine
CID 106459965
2-fluoro-5-(2-methylsulfonylethoxy)pyridine
CID 115371703
2-fluoro-5-[3-(2-methoxyethoxy)propoxy]pyridine
CID 103415782
N-[1-[5-[2-[(2-methylpropan-2-yl)oxy]ethoxy]-2-pyridinyl]ethyl]propan-1-amine
CID 115942116
2-fluoro-5-(2-phenylsulfanylethoxy)pyridine
CID 115371564
5-[(E)-but-2-enoxy]-2-fluoropyridine
CID 115371580
[4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]phenyl]boronic acid
CID 54970401
1-[4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]phenyl]ethanone
CID 112687603
(1R)-1-[4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]phenyl]propan-1-amine
CID 103939568
(1S)-1-[4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]phenyl]propan-1-amine
CID 113355509

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-5-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pyridine?
The IUPAC name of 2-fluoro-5-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pyridine (CID 112592625) is 2-fluoro-5-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pyridine.
What is the SMILES notation for 2-fluoro-5-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pyridine?
The canonical SMILES for 2-fluoro-5-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pyridine is CC(C)(C)OCCOc1ccc(F)nc1.
What is the InChIKey of 2-fluoro-5-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pyridine?
The InChIKey is ANCYAWUQEPUASE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16FNO2/c1-11(2,3)15-7-6-14-9-4-5-10(12)13-8-9/h4-5,8H,6-7H2,1-3H3.
What are the key properties of 2-fluoro-5-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pyridine?
2-fluoro-5-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pyridine has a molecular weight of 213.25 g/mol, XLogP of 2.41, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-5-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pyridine is sourced from PubChem (CID 112592625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).