5-bromo-2-(2,3-dimethoxyphenyl)pyridine

C13H12BrNO2 — CID 68621665

IUPAC5-bromo-2-(2,3-dimethoxyphenyl)pyridine
SMILESCOc1cccc(-c2ccc(Br)cn2)c1OC
InChIInChI=1S/C13H12BrNO2/c1-16-12-5-3-4-10(13(12)17-2)11-7-6-9(14)8-15-11/h3-8H,1-2H3
InChIKeyVNSWRZDZQOYXID-UHFFFAOYSA-N
MW294.15 g/mol
LogP3.53
Rot. Bonds3

About 5-bromo-2-(2,3-dimethoxyphenyl)pyridine

5-bromo-2-(2,3-dimethoxyphenyl)pyridine (PubChem CID 68621665) has the molecular formula C13H12BrNO2 and a molecular weight of 294.15 g/mol. Its IUPAC name is 5-bromo-2-(2,3-dimethoxyphenyl)pyridine.

Molecular Properties

Compound Name5-bromo-2-(2,3-dimethoxyphenyl)pyridine
PubChem CID68621665
Molecular FormulaC13H12BrNO2
Molecular Weight294.15 g/mol
Exact Mass293.01
IUPAC Name5-bromo-2-(2,3-dimethoxyphenyl)pyridine
SMILESCOc1cccc(-c2ccc(Br)cn2)c1OC
InChIInChI=1S/C13H12BrNO2/c1-16-12-5-3-4-10(13(12)17-2)11-7-6-9(14)8-15-11/h3-8H,1-2H3
InChIKeyVNSWRZDZQOYXID-UHFFFAOYSA-N
XLogP3.53
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.15
LogP ≤ 53.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

6-(2,3-dimethoxyphenyl)pyridin-3-amine
CID 82794989
5-fluoro-2-(2-methoxy-3-methylphenyl)pyridine
CID 170278839
N-(5-bromo-2-pyridinyl)-2,3-dimethoxybenzamide
CID 23931504
5-fluoro-2-(2-fluoro-3-methoxyphenyl)pyridine
CID 50961650
3-(2,3-dimethoxyphenyl)-6-(4-fluorophenyl)pyridazine
CID 77093795
5-bromo-2-[[2-(bromomethyl)-6-methoxyphenoxy]methyl]pyridine
CID 113454492
2-(5-bromo-2-pyridinyl)aniline
CID 130114483
5-(2,3-dimethoxyphenyl)-N-methyl-1,3-thiazol-2-amine
CID 116811899
2-[(5-bromo-2-pyridinyl)oxy]-3-methoxybenzoic acid
CID 61395806
(5Z)-5-[[6-(2,3-dimethoxyphenyl)-3-pyridinyl]methylidene]-3-methyl-2-sulfanylidene-1,3-thiazolidin-4-one
CID 131972073
5-(2,3-dimethoxyphenyl)pyrimidin-4-amine
CID 174611926
3-(2,3-dimethoxyphenyl)pyridine
CID 22001178

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-(2,3-dimethoxyphenyl)pyridine?
The IUPAC name of 5-bromo-2-(2,3-dimethoxyphenyl)pyridine (CID 68621665) is 5-bromo-2-(2,3-dimethoxyphenyl)pyridine.
What is the SMILES notation for 5-bromo-2-(2,3-dimethoxyphenyl)pyridine?
The canonical SMILES for 5-bromo-2-(2,3-dimethoxyphenyl)pyridine is COc1cccc(-c2ccc(Br)cn2)c1OC.
What is the InChIKey of 5-bromo-2-(2,3-dimethoxyphenyl)pyridine?
The InChIKey is VNSWRZDZQOYXID-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12BrNO2/c1-16-12-5-3-4-10(13(12)17-2)11-7-6-9(14)8-15-11/h3-8H,1-2H3.
What are the key properties of 5-bromo-2-(2,3-dimethoxyphenyl)pyridine?
5-bromo-2-(2,3-dimethoxyphenyl)pyridine has a molecular weight of 294.15 g/mol, XLogP of 3.53, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-(2,3-dimethoxyphenyl)pyridine is sourced from PubChem (CID 68621665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).