2-bromo-6-fluoro-4-methylpyridin-3-ol

C6H5BrFNO — CID 171795901

IUPAC2-bromo-6-fluoro-4-methylpyridin-3-ol
SMILESCc1cc(F)nc(Br)c1O
InChIInChI=1S/C6H5BrFNO/c1-3-2-4(8)9-6(7)5(3)10/h2,10H,1H3
InChIKeyJCOZFJSUEYMXAI-UHFFFAOYSA-N
MW206.01 g/mol
LogP2.00
Rot. Bonds

About 2-bromo-6-fluoro-4-methylpyridin-3-ol

2-bromo-6-fluoro-4-methylpyridin-3-ol (PubChem CID 171795901) has the molecular formula C6H5BrFNO and a molecular weight of 206.01 g/mol. Its IUPAC name is 2-bromo-6-fluoro-4-methylpyridin-3-ol.

Molecular Properties

Compound Name2-bromo-6-fluoro-4-methylpyridin-3-ol
PubChem CID171795901
Molecular FormulaC6H5BrFNO
Molecular Weight206.01 g/mol
Exact Mass204.95
IUPAC Name2-bromo-6-fluoro-4-methylpyridin-3-ol
SMILESCc1cc(F)nc(Br)c1O
InChIInChI=1S/C6H5BrFNO/c1-3-2-4(8)9-6(7)5(3)10/h2,10H,1H3
InChIKeyJCOZFJSUEYMXAI-UHFFFAOYSA-N
XLogP2.00
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.01
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-bromo-6-fluoro-4-methylpyridin-3-ol?
The IUPAC name of 2-bromo-6-fluoro-4-methylpyridin-3-ol (CID 171795901) is 2-bromo-6-fluoro-4-methylpyridin-3-ol.
What is the SMILES notation for 2-bromo-6-fluoro-4-methylpyridin-3-ol?
The canonical SMILES for 2-bromo-6-fluoro-4-methylpyridin-3-ol is Cc1cc(F)nc(Br)c1O.
What is the InChIKey of 2-bromo-6-fluoro-4-methylpyridin-3-ol?
The InChIKey is JCOZFJSUEYMXAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5BrFNO/c1-3-2-4(8)9-6(7)5(3)10/h2,10H,1H3.
What are the key properties of 2-bromo-6-fluoro-4-methylpyridin-3-ol?
2-bromo-6-fluoro-4-methylpyridin-3-ol has a molecular weight of 206.01 g/mol, XLogP of 2.00, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-6-fluoro-4-methylpyridin-3-ol is sourced from PubChem (CID 171795901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).