2-bromo-3-methoxy-6-phenylpyridine

C12H10BrNO — CID 10869126

IUPAC2-bromo-3-methoxy-6-phenylpyridine
SMILESCOc1ccc(-c2ccccc2)nc1Br
InChIInChI=1S/C12H10BrNO/c1-15-11-8-7-10(14-12(11)13)9-5-3-2-4-6-9/h2-8H,1H3
InChIKeyMUGVAKHFZQLVCX-UHFFFAOYSA-N
MW264.12 g/mol
LogP3.52
Rot. Bonds2

About 2-bromo-3-methoxy-6-phenylpyridine

2-bromo-3-methoxy-6-phenylpyridine (PubChem CID 10869126) has the molecular formula C12H10BrNO and a molecular weight of 264.12 g/mol. Its IUPAC name is 2-bromo-3-methoxy-6-phenylpyridine.

Molecular Properties

Compound Name2-bromo-3-methoxy-6-phenylpyridine
PubChem CID10869126
Molecular FormulaC12H10BrNO
Molecular Weight264.12 g/mol
Exact Mass262.99
IUPAC Name2-bromo-3-methoxy-6-phenylpyridine
SMILESCOc1ccc(-c2ccccc2)nc1Br
InChIInChI=1S/C12H10BrNO/c1-15-11-8-7-10(14-12(11)13)9-5-3-2-4-6-9/h2-8H,1H3
InChIKeyMUGVAKHFZQLVCX-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

Computed Properties (RDKit)

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

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Related Compounds

3-fluoro-2-methoxy-6-phenylpyridine
CID 133095533
2-bromo-6-phenyl-3-(4-phenylphenyl)pyridine
CID 142746925
2-bromo-3-methoxy-6-methylpyridine;ethane
CID 144796120
(2-methoxy-6-phenyl-3-pyridinyl)boronic acid
CID 2763125
2-(2-methoxyphenyl)-6-(6-phenyl-2-pyridinyl)pyridine
CID 23135803
5-bromo-4-methoxy-2-phenylpyridine
CID 139429745
2-azulen-2-yl-6,7-dimethoxyquinoline
CID 10591430
6-(3-aminophenyl)-3-methoxypyridin-2-amine
CID 82556270
3-methoxy-2-(3-nitrophenyl)-6-phenylpyridine
CID 11077630
2-methoxy-4,7-diphenylpyrido[2,3-d]pyrimidine
CID 10828998
4,7,8-trimethoxy-2-phenylquinoline
CID 20743676
3-bromo-2,6-diphenylpyridine
CID 56839636

Frequently Asked Questions

What is the IUPAC name of 2-bromo-3-methoxy-6-phenylpyridine?
The IUPAC name of 2-bromo-3-methoxy-6-phenylpyridine (CID 10869126) is 2-bromo-3-methoxy-6-phenylpyridine.
What is the SMILES notation for 2-bromo-3-methoxy-6-phenylpyridine?
The canonical SMILES for 2-bromo-3-methoxy-6-phenylpyridine is COc1ccc(-c2ccccc2)nc1Br.
What is the InChIKey of 2-bromo-3-methoxy-6-phenylpyridine?
The InChIKey is MUGVAKHFZQLVCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10BrNO/c1-15-11-8-7-10(14-12(11)13)9-5-3-2-4-6-9/h2-8H,1H3.
What are the key properties of 2-bromo-3-methoxy-6-phenylpyridine?
2-bromo-3-methoxy-6-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 2-bromo-3-methoxy-6-phenylpyridine is sourced from PubChem (CID 10869126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).