2-(2,5-dimethylpyrazol-3-yl)oxy-6-fluoropyridine

C10H10FN3O — CID 81346366

IUPAC2-(2,5-dimethylpyrazol-3-yl)oxy-6-fluoropyridine
SMILESCc1cc(Oc2cccc(F)n2)n(C)n1
InChIInChI=1S/C10H10FN3O/c1-7-6-10(14(2)13-7)15-9-5-3-4-8(11)12-9/h3-6H,1-2H3
InChIKeyVLRQFGBOOVQFHZ-UHFFFAOYSA-N
MW207.21 g/mol
LogP2.05
Rot. Bonds2

About 2-(2,5-dimethylpyrazol-3-yl)oxy-6-fluoropyridine

2-(2,5-dimethylpyrazol-3-yl)oxy-6-fluoropyridine (PubChem CID 81346366) has the molecular formula C10H10FN3O and a molecular weight of 207.21 g/mol. Its IUPAC name is 2-(2,5-dimethylpyrazol-3-yl)oxy-6-fluoropyridine.

Molecular Properties

Compound Name2-(2,5-dimethylpyrazol-3-yl)oxy-6-fluoropyridine
PubChem CID81346366
Molecular FormulaC10H10FN3O
Molecular Weight207.21 g/mol
Exact Mass207.08
IUPAC Name2-(2,5-dimethylpyrazol-3-yl)oxy-6-fluoropyridine
SMILESCc1cc(Oc2cccc(F)n2)n(C)n1
InChIInChI=1S/C10H10FN3O/c1-7-6-10(14(2)13-7)15-9-5-3-4-8(11)12-9/h3-6H,1-2H3
InChIKeyVLRQFGBOOVQFHZ-UHFFFAOYSA-N
XLogP2.05
TPSA39.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.21
LogP ≤ 52.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylpyrazol-3-yl)oxy-6-fluoropyridine?
The IUPAC name of 2-(2,5-dimethylpyrazol-3-yl)oxy-6-fluoropyridine (CID 81346366) is 2-(2,5-dimethylpyrazol-3-yl)oxy-6-fluoropyridine.
What is the SMILES notation for 2-(2,5-dimethylpyrazol-3-yl)oxy-6-fluoropyridine?
The canonical SMILES for 2-(2,5-dimethylpyrazol-3-yl)oxy-6-fluoropyridine is Cc1cc(Oc2cccc(F)n2)n(C)n1.
What is the InChIKey of 2-(2,5-dimethylpyrazol-3-yl)oxy-6-fluoropyridine?
The InChIKey is VLRQFGBOOVQFHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FN3O/c1-7-6-10(14(2)13-7)15-9-5-3-4-8(11)12-9/h3-6H,1-2H3.
What are the key properties of 2-(2,5-dimethylpyrazol-3-yl)oxy-6-fluoropyridine?
2-(2,5-dimethylpyrazol-3-yl)oxy-6-fluoropyridine has a molecular weight of 207.21 g/mol, XLogP of 2.05, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethylpyrazol-3-yl)oxy-6-fluoropyridine is sourced from PubChem (CID 81346366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).