5-[(4-fluorophenyl)methoxy]-2-(1H-pyrazol-5-yl)pyridine

C15H12FN3O — CID 155790628

IUPAC5-[(4-fluorophenyl)methoxy]-2-(1H-pyrazol-5-yl)pyridine
SMILESFc1ccc(COc2ccc(-c3ccn[nH]3)nc2)cc1
InChIInChI=1S/C15H12FN3O/c16-12-3-1-11(2-4-12)10-20-13-5-6-14(17-9-13)15-7-8-18-19-15/h1-9H,10H2,(H,18,19)
InChIKeyGYFKAUWQVHEBQR-UHFFFAOYSA-N
MW269.28 g/mol
LogP3.19
Rot. Bonds4

About 5-[(4-fluorophenyl)methoxy]-2-(1H-pyrazol-5-yl)pyridine

5-[(4-fluorophenyl)methoxy]-2-(1H-pyrazol-5-yl)pyridine (PubChem CID 155790628) has the molecular formula C15H12FN3O and a molecular weight of 269.28 g/mol. Its IUPAC name is 5-[(4-fluorophenyl)methoxy]-2-(1H-pyrazol-5-yl)pyridine.

Molecular Properties

Compound Name5-[(4-fluorophenyl)methoxy]-2-(1H-pyrazol-5-yl)pyridine
PubChem CID155790628
Molecular FormulaC15H12FN3O
Molecular Weight269.28 g/mol
Exact Mass269.10
IUPAC Name5-[(4-fluorophenyl)methoxy]-2-(1H-pyrazol-5-yl)pyridine
SMILESFc1ccc(COc2ccc(-c3ccn[nH]3)nc2)cc1
InChIInChI=1S/C15H12FN3O/c16-12-3-1-11(2-4-12)10-20-13-5-6-14(17-9-13)15-7-8-18-19-15/h1-9H,10H2,(H,18,19)
InChIKeyGYFKAUWQVHEBQR-UHFFFAOYSA-N
XLogP3.19
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.28
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-[(4-fluorophenyl)methoxy]-2-(1H-pyrazol-5-yl)pyridine?
The IUPAC name of 5-[(4-fluorophenyl)methoxy]-2-(1H-pyrazol-5-yl)pyridine (CID 155790628) is 5-[(4-fluorophenyl)methoxy]-2-(1H-pyrazol-5-yl)pyridine.
What is the SMILES notation for 5-[(4-fluorophenyl)methoxy]-2-(1H-pyrazol-5-yl)pyridine?
The canonical SMILES for 5-[(4-fluorophenyl)methoxy]-2-(1H-pyrazol-5-yl)pyridine is Fc1ccc(COc2ccc(-c3ccn[nH]3)nc2)cc1.
What is the InChIKey of 5-[(4-fluorophenyl)methoxy]-2-(1H-pyrazol-5-yl)pyridine?
The InChIKey is GYFKAUWQVHEBQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12FN3O/c16-12-3-1-11(2-4-12)10-20-13-5-6-14(17-9-13)15-7-8-18-19-15/h1-9H,10H2,(H,18,19).
What are the key properties of 5-[(4-fluorophenyl)methoxy]-2-(1H-pyrazol-5-yl)pyridine?
5-[(4-fluorophenyl)methoxy]-2-(1H-pyrazol-5-yl)pyridine has a molecular weight of 269.28 g/mol, XLogP of 3.19, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(4-fluorophenyl)methoxy]-2-(1H-pyrazol-5-yl)pyridine is sourced from PubChem (CID 155790628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).