[5-[2-(2-fluoroethoxy)ethoxy]-2-pyridinyl]methanol

C10H14FNO3 — CID 122423801

IUPAC[5-[2-(2-fluoroethoxy)ethoxy]-2-pyridinyl]methanol
SMILESOCc1ccc(OCCOCCF)cn1
InChIInChI=1S/C10H14FNO3/c11-3-4-14-5-6-15-10-2-1-9(8-13)12-7-10/h1-2,7,13H,3-6,8H2
InChIKeyBJSBUMBEUYPARC-UHFFFAOYSA-N
MW215.22 g/mol
LogP0.94
Rot. Bonds7

About [5-[2-(2-fluoroethoxy)ethoxy]-2-pyridinyl]methanol

[5-[2-(2-fluoroethoxy)ethoxy]-2-pyridinyl]methanol (PubChem CID 122423801) has the molecular formula C10H14FNO3 and a molecular weight of 215.22 g/mol. Its IUPAC name is [5-[2-(2-fluoroethoxy)ethoxy]-2-pyridinyl]methanol.

Molecular Properties

Compound Name[5-[2-(2-fluoroethoxy)ethoxy]-2-pyridinyl]methanol
PubChem CID122423801
Molecular FormulaC10H14FNO3
Molecular Weight215.22 g/mol
Exact Mass215.10
IUPAC Name[5-[2-(2-fluoroethoxy)ethoxy]-2-pyridinyl]methanol
SMILESOCc1ccc(OCCOCCF)cn1
InChIInChI=1S/C10H14FNO3/c11-3-4-14-5-6-15-10-2-1-9(8-13)12-7-10/h1-2,7,13H,3-6,8H2
InChIKeyBJSBUMBEUYPARC-UHFFFAOYSA-N
XLogP0.94
TPSA51.58 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.22
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [5-[2-(2-fluoroethoxy)ethoxy]-2-pyridinyl]methanol?
The IUPAC name of [5-[2-(2-fluoroethoxy)ethoxy]-2-pyridinyl]methanol (CID 122423801) is [5-[2-(2-fluoroethoxy)ethoxy]-2-pyridinyl]methanol.
What is the SMILES notation for [5-[2-(2-fluoroethoxy)ethoxy]-2-pyridinyl]methanol?
The canonical SMILES for [5-[2-(2-fluoroethoxy)ethoxy]-2-pyridinyl]methanol is OCc1ccc(OCCOCCF)cn1.
What is the InChIKey of [5-[2-(2-fluoroethoxy)ethoxy]-2-pyridinyl]methanol?
The InChIKey is BJSBUMBEUYPARC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14FNO3/c11-3-4-14-5-6-15-10-2-1-9(8-13)12-7-10/h1-2,7,13H,3-6,8H2.
What are the key properties of [5-[2-(2-fluoroethoxy)ethoxy]-2-pyridinyl]methanol?
[5-[2-(2-fluoroethoxy)ethoxy]-2-pyridinyl]methanol has a molecular weight of 215.22 g/mol, XLogP of 0.94, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[2-(2-fluoroethoxy)ethoxy]-2-pyridinyl]methanol is sourced from PubChem (CID 122423801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).