2,3-dibromo-5,6-dimethoxypyridine

C7H7Br2NO2 — CID 23056693

IUPAC2,3-dibromo-5,6-dimethoxypyridine
SMILESCOc1cc(Br)c(Br)nc1OC
InChIInChI=1S/C7H7Br2NO2/c1-11-5-3-4(8)6(9)10-7(5)12-2/h3H,1-2H3
InChIKeyOSULVQGSODZGMD-UHFFFAOYSA-N
MW296.95 g/mol
LogP2.62
Rot. Bonds2

About 2,3-dibromo-5,6-dimethoxypyridine

2,3-dibromo-5,6-dimethoxypyridine (PubChem CID 23056693) has the molecular formula C7H7Br2NO2 and a molecular weight of 296.95 g/mol. Its IUPAC name is 2,3-dibromo-5,6-dimethoxypyridine.

Molecular Properties

Compound Name2,3-dibromo-5,6-dimethoxypyridine
PubChem CID23056693
Molecular FormulaC7H7Br2NO2
Molecular Weight296.95 g/mol
Exact Mass294.88
IUPAC Name2,3-dibromo-5,6-dimethoxypyridine
SMILESCOc1cc(Br)c(Br)nc1OC
InChIInChI=1S/C7H7Br2NO2/c1-11-5-3-4(8)6(9)10-7(5)12-2/h3H,1-2H3
InChIKeyOSULVQGSODZGMD-UHFFFAOYSA-N
XLogP2.62
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.95
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2,3-dibromo-5,6-dimethoxypyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,3-dibromo-5-(difluoromethyl)-6-methoxypyridine
CID 119011483
5-bromo-3,6-dimethoxypyridine-2-carbaldehyde
CID 176871253
2-bromo-3,6-dimethoxy-5-nitropyridine
CID 172541269
1-bromo-2,4-difluoro-5-methoxybenzene
CID 68809379
5-bromo-3-fluoro-2-methoxy-6-methylpyridine
CID 52982885
3-bromo-5-methoxy-6-methylpyridin-2-amine
CID 130133402
3-chloro-2-iodo-5,6-dimethoxypyridine
CID 77230174
1-bromo-2,4-difluoro-5-methoxybenzene;1,5-dibromo-2,4-difluorobenzene
CID 160948339
5-bromo-6-fluoro-3-methoxypyridin-2-amine
CID 135201063
1-(2,5,6-trimethoxy-3-pyridinyl)ethanone
CID 71300170
2,3-ditert-butyl-5,6-dimethoxypyridine
CID 155787492
2-bromo-5-chloro-3-(difluoromethoxy)-6-methoxypyridine
CID 167456312

Frequently Asked Questions

What is the IUPAC name of 2,3-dibromo-5,6-dimethoxypyridine?
The IUPAC name of 2,3-dibromo-5,6-dimethoxypyridine (CID 23056693) is 2,3-dibromo-5,6-dimethoxypyridine.
What is the SMILES notation for 2,3-dibromo-5,6-dimethoxypyridine?
The canonical SMILES for 2,3-dibromo-5,6-dimethoxypyridine is COc1cc(Br)c(Br)nc1OC.
What is the InChIKey of 2,3-dibromo-5,6-dimethoxypyridine?
The InChIKey is OSULVQGSODZGMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7Br2NO2/c1-11-5-3-4(8)6(9)10-7(5)12-2/h3H,1-2H3.
What are the key properties of 2,3-dibromo-5,6-dimethoxypyridine?
2,3-dibromo-5,6-dimethoxypyridine has a molecular weight of 296.95 g/mol, XLogP of 2.62, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dibromo-5,6-dimethoxypyridine is sourced from PubChem (CID 23056693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).