3-(ethoxymethoxy)-4-fluoropyridine

C8H10FNO2 — CID 89264682

IUPAC3-(ethoxymethoxy)-4-fluoropyridine
SMILESCCOCOc1cnccc1F
InChIInChI=1S/C8H10FNO2/c1-2-11-6-12-8-5-10-4-3-7(8)9/h3-5H,2,6H2,1H3
InChIKeyMGORSQGGOIGCIB-UHFFFAOYSA-N
MW171.17 g/mol
LogP1.59
Rot. Bonds4

About 3-(ethoxymethoxy)-4-fluoropyridine

3-(ethoxymethoxy)-4-fluoropyridine (PubChem CID 89264682) has the molecular formula C8H10FNO2 and a molecular weight of 171.17 g/mol. Its IUPAC name is 3-(ethoxymethoxy)-4-fluoropyridine.

Molecular Properties

Compound Name3-(ethoxymethoxy)-4-fluoropyridine
PubChem CID89264682
Molecular FormulaC8H10FNO2
Molecular Weight171.17 g/mol
Exact Mass171.07
IUPAC Name3-(ethoxymethoxy)-4-fluoropyridine
SMILESCCOCOc1cnccc1F
InChIInChI=1S/C8H10FNO2/c1-2-11-6-12-8-5-10-4-3-7(8)9/h3-5H,2,6H2,1H3
InChIKeyMGORSQGGOIGCIB-UHFFFAOYSA-N
XLogP1.59
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.17
LogP ≤ 51.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

Pyridostigmine Bromide
CID 7550
Pyridostigmine
CID 4991
3-Methoxypyridine
CID 23719
3-Pyridyl acetate
CID 87289
Norpyridostigmine
CID 98821
3-(2-(N,N,N-trimethylammonium)ethoxy)pyridine
CID 9794401
2-Fluoro-A-85380
CID 10241442
2-Fluoro-3-(2S-azetidinylmethoxy)pyridine, F-18
CID 450860
N-methyl-2-(pyridin-3-yloxy)ethanamine
CID 9793858
N,N-dimethyl-2-(pyridin-3-yloxy)ethanamine
CID 10197862
5-[[(2R)-azetidin-2-yl]methoxy]-2-fluoropyridine
CID 10313392
5-[[(2S)-azetidin-2-yl]methoxy]-2-fluoropyridine
CID 10375065

Frequently Asked Questions

What is the IUPAC name of 3-(ethoxymethoxy)-4-fluoropyridine?
The IUPAC name of 3-(ethoxymethoxy)-4-fluoropyridine (CID 89264682) is 3-(ethoxymethoxy)-4-fluoropyridine.
What is the SMILES notation for 3-(ethoxymethoxy)-4-fluoropyridine?
The canonical SMILES for 3-(ethoxymethoxy)-4-fluoropyridine is CCOCOc1cnccc1F.
What is the InChIKey of 3-(ethoxymethoxy)-4-fluoropyridine?
The InChIKey is MGORSQGGOIGCIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10FNO2/c1-2-11-6-12-8-5-10-4-3-7(8)9/h3-5H,2,6H2,1H3.
What are the key properties of 3-(ethoxymethoxy)-4-fluoropyridine?
3-(ethoxymethoxy)-4-fluoropyridine has a molecular weight of 171.17 g/mol, XLogP of 1.59, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(ethoxymethoxy)-4-fluoropyridine is sourced from PubChem (CID 89264682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).