2-fluoro-5-[3-(2-methoxyethoxy)propoxy]pyridine

C11H16FNO3 — CID 103415782

IUPAC2-fluoro-5-[3-(2-methoxyethoxy)propoxy]pyridine
SMILESCOCCOCCCOc1ccc(F)nc1
InChIInChI=1S/C11H16FNO3/c1-14-7-8-15-5-2-6-16-10-3-4-11(12)13-9-10/h3-4,9H,2,5-8H2,1H3
InChIKeyOJPVCCWXOCHMBJ-UHFFFAOYSA-N
MW229.25 g/mol
LogP1.65
Rot. Bonds8

About 2-fluoro-5-[3-(2-methoxyethoxy)propoxy]pyridine

2-fluoro-5-[3-(2-methoxyethoxy)propoxy]pyridine (PubChem CID 103415782) has the molecular formula C11H16FNO3 and a molecular weight of 229.25 g/mol. Its IUPAC name is 2-fluoro-5-[3-(2-methoxyethoxy)propoxy]pyridine.

Molecular Properties

Compound Name2-fluoro-5-[3-(2-methoxyethoxy)propoxy]pyridine
PubChem CID103415782
Molecular FormulaC11H16FNO3
Molecular Weight229.25 g/mol
Exact Mass229.11
IUPAC Name2-fluoro-5-[3-(2-methoxyethoxy)propoxy]pyridine
SMILESCOCCOCCCOc1ccc(F)nc1
InChIInChI=1S/C11H16FNO3/c1-14-7-8-15-5-2-6-16-10-3-4-11(12)13-9-10/h3-4,9H,2,5-8H2,1H3
InChIKeyOJPVCCWXOCHMBJ-UHFFFAOYSA-N
XLogP1.65
TPSA40.58 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.25
LogP ≤ 51.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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

2-fluoro-5-hexoxypyridine
CID 115371648
2-fluoro-5-[2-(2-methylpropoxy)ethoxy]pyridine
CID 106459965
1-[5-[3-(2-methoxyethoxy)propoxy]-2-pyridinyl]-N-methylpropan-1-amine
CID 103403032
[5-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-pyridinyl]methanol
CID 104564081
5-[2-(3-methoxypropoxy)ethoxy]pyridine-2-carbothioamide
CID 103177661
2-fluoro-5-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pyridine
CID 112592625
2-fluoro-4-[2-(3-methoxypropoxy)ethoxy]-1-methylbenzene
CID 107171281
2-fluoro-5-(2-methylsulfonylethoxy)pyridine
CID 115371703
N-ethyl-1-[5-[2-(3-methoxypropoxy)ethoxy]-2-pyridinyl]ethanamine
CID 103178120
1-[2-fluoro-4-[3-(2-methoxyethoxy)propoxy]phenyl]ethanamine
CID 107715807
4-[5-(2-methoxyethoxy)pentoxy]aniline
CID 3026839
(1R)-1-[4-[3-(2-methoxyethoxy)propoxy]phenyl]ethanamine
CID 103402999

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-5-[3-(2-methoxyethoxy)propoxy]pyridine?
The IUPAC name of 2-fluoro-5-[3-(2-methoxyethoxy)propoxy]pyridine (CID 103415782) is 2-fluoro-5-[3-(2-methoxyethoxy)propoxy]pyridine.
What is the SMILES notation for 2-fluoro-5-[3-(2-methoxyethoxy)propoxy]pyridine?
The canonical SMILES for 2-fluoro-5-[3-(2-methoxyethoxy)propoxy]pyridine is COCCOCCCOc1ccc(F)nc1.
What is the InChIKey of 2-fluoro-5-[3-(2-methoxyethoxy)propoxy]pyridine?
The InChIKey is OJPVCCWXOCHMBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16FNO3/c1-14-7-8-15-5-2-6-16-10-3-4-11(12)13-9-10/h3-4,9H,2,5-8H2,1H3.
What are the key properties of 2-fluoro-5-[3-(2-methoxyethoxy)propoxy]pyridine?
2-fluoro-5-[3-(2-methoxyethoxy)propoxy]pyridine has a molecular weight of 229.25 g/mol, XLogP of 1.65, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-5-[3-(2-methoxyethoxy)propoxy]pyridine is sourced from PubChem (CID 103415782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).