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5-Bromo-4-methoxy-2-phenylpyridine

C12H10BrNO — CID 139429745

Data last refreshed: (MolForge compound catalog, from PubChem)

IUPAC5-bromo-4-methoxy-2-phenylpyridine
SMILESCOc1cc(-c2ccccc2)ncc1Br
InChIInChI=1S/C12H10BrNO/c1-15-12-7-11(14-8-10(12)13)9-5-3-2-4-6-9/h2-8H,1H3
InChIKeyQWHDVFKLQQFKGA-UHFFFAOYSA-N
MW264.12 g/mol
LogP3.52
Rot. Bonds2

About 5-Bromo-4-methoxy-2-phenylpyridine

5-Bromo-4-methoxy-2-phenylpyridine (PubChem CID 139429745) has the molecular formula C12H10BrNO and a molecular weight of 264.12 g/mol. Its IUPAC name is 5-bromo-4-methoxy-2-phenylpyridine.

Molecular Properties

Compound Name5-Bromo-4-methoxy-2-phenylpyridine
PubChem CID139429745
Molecular FormulaC12H10BrNO
Molecular Weight264.12 g/mol
Exact Mass262.99
IUPAC Name5-bromo-4-methoxy-2-phenylpyridine
SMILESCOc1cc(-c2ccccc2)ncc1Br
InChIInChI=1S/C12H10BrNO/c1-15-12-7-11(14-8-10(12)13)9-5-3-2-4-6-9/h2-8H,1H3
InChIKeyQWHDVFKLQQFKGA-UHFFFAOYSA-N
XLogP3.52
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.12
LogP ≤ 53.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-Bromo-4-methoxy-2-phenylpyridine?
The IUPAC name of 5-Bromo-4-methoxy-2-phenylpyridine (CID 139429745) is 5-bromo-4-methoxy-2-phenylpyridine.
What is the SMILES notation for 5-Bromo-4-methoxy-2-phenylpyridine?
The canonical SMILES for 5-Bromo-4-methoxy-2-phenylpyridine is COc1cc(-c2ccccc2)ncc1Br.
What is the InChIKey of 5-Bromo-4-methoxy-2-phenylpyridine?
The InChIKey is QWHDVFKLQQFKGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10BrNO/c1-15-12-7-11(14-8-10(12)13)9-5-3-2-4-6-9/h2-8H,1H3.
What are the key properties of 5-Bromo-4-methoxy-2-phenylpyridine?
5-Bromo-4-methoxy-2-phenylpyridine has a molecular weight of 264.12 g/mol, XLogP of 3.52, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-Bromo-4-methoxy-2-phenylpyridine is sourced from PubChem (CID 139429745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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