3-fluoro-5-(3-methylpyrazol-1-yl)pyridine

C9H8FN3 — CID 67499765

IUPAC3-fluoro-5-(3-methylpyrazol-1-yl)pyridine
SMILESCc1ccn(-c2cncc(F)c2)n1
InChIInChI=1S/C9H8FN3/c1-7-2-3-13(12-7)9-4-8(10)5-11-6-9/h2-6H,1H3
InChIKeyBTHLWUMEXABJLL-UHFFFAOYSA-N
MW177.18 g/mol
LogP1.71
Rot. Bonds1

About 3-fluoro-5-(3-methylpyrazol-1-yl)pyridine

3-fluoro-5-(3-methylpyrazol-1-yl)pyridine (PubChem CID 67499765) has the molecular formula C9H8FN3 and a molecular weight of 177.18 g/mol. Its IUPAC name is 3-fluoro-5-(3-methylpyrazol-1-yl)pyridine.

Molecular Properties

Compound Name3-fluoro-5-(3-methylpyrazol-1-yl)pyridine
PubChem CID67499765
Molecular FormulaC9H8FN3
Molecular Weight177.18 g/mol
Exact Mass177.07
IUPAC Name3-fluoro-5-(3-methylpyrazol-1-yl)pyridine
SMILESCc1ccn(-c2cncc(F)c2)n1
InChIInChI=1S/C9H8FN3/c1-7-2-3-13(12-7)9-4-8(10)5-11-6-9/h2-6H,1H3
InChIKeyBTHLWUMEXABJLL-UHFFFAOYSA-N
XLogP1.71
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.18
LogP ≤ 51.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-fluoro-5-(3-methylpyrazol-1-yl)pyridine?
The IUPAC name of 3-fluoro-5-(3-methylpyrazol-1-yl)pyridine (CID 67499765) is 3-fluoro-5-(3-methylpyrazol-1-yl)pyridine.
What is the SMILES notation for 3-fluoro-5-(3-methylpyrazol-1-yl)pyridine?
The canonical SMILES for 3-fluoro-5-(3-methylpyrazol-1-yl)pyridine is Cc1ccn(-c2cncc(F)c2)n1.
What is the InChIKey of 3-fluoro-5-(3-methylpyrazol-1-yl)pyridine?
The InChIKey is BTHLWUMEXABJLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8FN3/c1-7-2-3-13(12-7)9-4-8(10)5-11-6-9/h2-6H,1H3.
What are the key properties of 3-fluoro-5-(3-methylpyrazol-1-yl)pyridine?
3-fluoro-5-(3-methylpyrazol-1-yl)pyridine has a molecular weight of 177.18 g/mol, XLogP of 1.71, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-5-(3-methylpyrazol-1-yl)pyridine is sourced from PubChem (CID 67499765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).