6-(4-bromo-1-methylpyrazol-3-yl)-3-fluoro-2-methylpyridine

C10H9BrFN3 — CID 134202435

IUPAC6-(4-bromo-1-methylpyrazol-3-yl)-3-fluoro-2-methylpyridine
SMILESCc1nc(-c2nn(C)cc2Br)ccc1F
InChIInChI=1S/C10H9BrFN3/c1-6-8(12)3-4-9(13-6)10-7(11)5-15(2)14-10/h3-5H,1-2H3
InChIKeyCCOBFHQWOWZLJK-UHFFFAOYSA-N
MW270.11 g/mol
LogP2.69
Rot. Bonds1

About 6-(4-bromo-1-methylpyrazol-3-yl)-3-fluoro-2-methylpyridine

6-(4-bromo-1-methylpyrazol-3-yl)-3-fluoro-2-methylpyridine (PubChem CID 134202435) has the molecular formula C10H9BrFN3 and a molecular weight of 270.11 g/mol. Its IUPAC name is 6-(4-bromo-1-methylpyrazol-3-yl)-3-fluoro-2-methylpyridine.

Molecular Properties

Compound Name6-(4-bromo-1-methylpyrazol-3-yl)-3-fluoro-2-methylpyridine
PubChem CID134202435
Molecular FormulaC10H9BrFN3
Molecular Weight270.11 g/mol
Exact Mass269.00
IUPAC Name6-(4-bromo-1-methylpyrazol-3-yl)-3-fluoro-2-methylpyridine
SMILESCc1nc(-c2nn(C)cc2Br)ccc1F
InChIInChI=1S/C10H9BrFN3/c1-6-8(12)3-4-9(13-6)10-7(11)5-15(2)14-10/h3-5H,1-2H3
InChIKeyCCOBFHQWOWZLJK-UHFFFAOYSA-N
XLogP2.69
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.11
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(4-bromo-1-methylpyrazol-3-yl)-3-fluoro-2-methylpyridine?
The IUPAC name of 6-(4-bromo-1-methylpyrazol-3-yl)-3-fluoro-2-methylpyridine (CID 134202435) is 6-(4-bromo-1-methylpyrazol-3-yl)-3-fluoro-2-methylpyridine.
What is the SMILES notation for 6-(4-bromo-1-methylpyrazol-3-yl)-3-fluoro-2-methylpyridine?
The canonical SMILES for 6-(4-bromo-1-methylpyrazol-3-yl)-3-fluoro-2-methylpyridine is Cc1nc(-c2nn(C)cc2Br)ccc1F.
What is the InChIKey of 6-(4-bromo-1-methylpyrazol-3-yl)-3-fluoro-2-methylpyridine?
The InChIKey is CCOBFHQWOWZLJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9BrFN3/c1-6-8(12)3-4-9(13-6)10-7(11)5-15(2)14-10/h3-5H,1-2H3.
What are the key properties of 6-(4-bromo-1-methylpyrazol-3-yl)-3-fluoro-2-methylpyridine?
6-(4-bromo-1-methylpyrazol-3-yl)-3-fluoro-2-methylpyridine has a molecular weight of 270.11 g/mol, XLogP of 2.69, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-bromo-1-methylpyrazol-3-yl)-3-fluoro-2-methylpyridine is sourced from PubChem (CID 134202435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).