3-fluoro-6-methyl-2-(1H-pyrazol-5-yl)pyridine

C9H8FN3 — CID 134517525

IUPAC3-fluoro-6-methyl-2-(1H-pyrazol-5-yl)pyridine
SMILESCc1ccc(F)c(-c2ccn[nH]2)n1
InChIInChI=1S/C9H8FN3/c1-6-2-3-7(10)9(12-6)8-4-5-11-13-8/h2-5H,1H3,(H,11,13)
InChIKeyBSGTVOZIBIWBGH-UHFFFAOYSA-N
MW177.18 g/mol
LogP1.92
Rot. Bonds1

About 3-fluoro-6-methyl-2-(1H-pyrazol-5-yl)pyridine

3-fluoro-6-methyl-2-(1H-pyrazol-5-yl)pyridine (PubChem CID 134517525) has the molecular formula C9H8FN3 and a molecular weight of 177.18 g/mol. Its IUPAC name is 3-fluoro-6-methyl-2-(1H-pyrazol-5-yl)pyridine.

Molecular Properties

Compound Name3-fluoro-6-methyl-2-(1H-pyrazol-5-yl)pyridine
PubChem CID134517525
Molecular FormulaC9H8FN3
Molecular Weight177.18 g/mol
Exact Mass177.07
IUPAC Name3-fluoro-6-methyl-2-(1H-pyrazol-5-yl)pyridine
SMILESCc1ccc(F)c(-c2ccn[nH]2)n1
InChIInChI=1S/C9H8FN3/c1-6-2-3-7(10)9(12-6)8-4-5-11-13-8/h2-5H,1H3,(H,11,13)
InChIKeyBSGTVOZIBIWBGH-UHFFFAOYSA-N
XLogP1.92
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.18
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-fluoro-6-methyl-2-(1H-pyrazol-5-yl)pyridine?
The IUPAC name of 3-fluoro-6-methyl-2-(1H-pyrazol-5-yl)pyridine (CID 134517525) is 3-fluoro-6-methyl-2-(1H-pyrazol-5-yl)pyridine.
What is the SMILES notation for 3-fluoro-6-methyl-2-(1H-pyrazol-5-yl)pyridine?
The canonical SMILES for 3-fluoro-6-methyl-2-(1H-pyrazol-5-yl)pyridine is Cc1ccc(F)c(-c2ccn[nH]2)n1.
What is the InChIKey of 3-fluoro-6-methyl-2-(1H-pyrazol-5-yl)pyridine?
The InChIKey is BSGTVOZIBIWBGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8FN3/c1-6-2-3-7(10)9(12-6)8-4-5-11-13-8/h2-5H,1H3,(H,11,13).
What are the key properties of 3-fluoro-6-methyl-2-(1H-pyrazol-5-yl)pyridine?
3-fluoro-6-methyl-2-(1H-pyrazol-5-yl)pyridine has a molecular weight of 177.18 g/mol, XLogP of 1.92, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-6-methyl-2-(1H-pyrazol-5-yl)pyridine is sourced from PubChem (CID 134517525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).