5-chloro-3-fluoro-2-(5-methoxy-1-methylpyrazol-3-yl)pyridine

C10H9ClFN3O — CID 131875828

IUPAC5-chloro-3-fluoro-2-(5-methoxy-1-methylpyrazol-3-yl)pyridine
SMILESCOc1cc(-c2ncc(Cl)cc2F)nn1C
InChIInChI=1S/C10H9ClFN3O/c1-15-9(16-2)4-8(14-15)10-7(12)3-6(11)5-13-10/h3-5H,1-2H3
InChIKeyUPHSNYXINXSNKJ-UHFFFAOYSA-N
MW241.65 g/mol
LogP2.28
Rot. Bonds2

About 5-chloro-3-fluoro-2-(5-methoxy-1-methylpyrazol-3-yl)pyridine

5-chloro-3-fluoro-2-(5-methoxy-1-methylpyrazol-3-yl)pyridine (PubChem CID 131875828) has the molecular formula C10H9ClFN3O and a molecular weight of 241.65 g/mol. Its IUPAC name is 5-chloro-3-fluoro-2-(5-methoxy-1-methylpyrazol-3-yl)pyridine.

Molecular Properties

Compound Name5-chloro-3-fluoro-2-(5-methoxy-1-methylpyrazol-3-yl)pyridine
PubChem CID131875828
Molecular FormulaC10H9ClFN3O
Molecular Weight241.65 g/mol
Exact Mass241.04
IUPAC Name5-chloro-3-fluoro-2-(5-methoxy-1-methylpyrazol-3-yl)pyridine
SMILESCOc1cc(-c2ncc(Cl)cc2F)nn1C
InChIInChI=1S/C10H9ClFN3O/c1-15-9(16-2)4-8(14-15)10-7(12)3-6(11)5-13-10/h3-5H,1-2H3
InChIKeyUPHSNYXINXSNKJ-UHFFFAOYSA-N
XLogP2.28
TPSA39.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.65
LogP ≤ 52.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-3-fluoro-2-(5-methoxy-1-methylpyrazol-3-yl)pyridine?
The IUPAC name of 5-chloro-3-fluoro-2-(5-methoxy-1-methylpyrazol-3-yl)pyridine (CID 131875828) is 5-chloro-3-fluoro-2-(5-methoxy-1-methylpyrazol-3-yl)pyridine.
What is the SMILES notation for 5-chloro-3-fluoro-2-(5-methoxy-1-methylpyrazol-3-yl)pyridine?
The canonical SMILES for 5-chloro-3-fluoro-2-(5-methoxy-1-methylpyrazol-3-yl)pyridine is COc1cc(-c2ncc(Cl)cc2F)nn1C.
What is the InChIKey of 5-chloro-3-fluoro-2-(5-methoxy-1-methylpyrazol-3-yl)pyridine?
The InChIKey is UPHSNYXINXSNKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9ClFN3O/c1-15-9(16-2)4-8(14-15)10-7(12)3-6(11)5-13-10/h3-5H,1-2H3.
What are the key properties of 5-chloro-3-fluoro-2-(5-methoxy-1-methylpyrazol-3-yl)pyridine?
5-chloro-3-fluoro-2-(5-methoxy-1-methylpyrazol-3-yl)pyridine has a molecular weight of 241.65 g/mol, XLogP of 2.28, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-3-fluoro-2-(5-methoxy-1-methylpyrazol-3-yl)pyridine is sourced from PubChem (CID 131875828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).