4-bromo-3,5-diiodo-2,6-dimethylpyridine

C7H6BrI2N — CID 84819921

IUPAC4-bromo-3,5-diiodo-2,6-dimethylpyridine
SMILESCc1nc(C)c(I)c(Br)c1I
InChIInChI=1S/C7H6BrI2N/c1-3-6(9)5(8)7(10)4(2)11-3/h1-2H3
InChIKeyGPNCDEWHWQJCPN-UHFFFAOYSA-N
MW437.84 g/mol
LogP3.67
Rot. Bonds

About 4-bromo-3,5-diiodo-2,6-dimethylpyridine

4-bromo-3,5-diiodo-2,6-dimethylpyridine (PubChem CID 84819921) has the molecular formula C7H6BrI2N and a molecular weight of 437.84 g/mol. Its IUPAC name is 4-bromo-3,5-diiodo-2,6-dimethylpyridine.

Molecular Properties

Compound Name4-bromo-3,5-diiodo-2,6-dimethylpyridine
PubChem CID84819921
Molecular FormulaC7H6BrI2N
Molecular Weight437.84 g/mol
Exact Mass436.78
IUPAC Name4-bromo-3,5-diiodo-2,6-dimethylpyridine
SMILESCc1nc(C)c(I)c(Br)c1I
InChIInChI=1S/C7H6BrI2N/c1-3-6(9)5(8)7(10)4(2)11-3/h1-2H3
InChIKeyGPNCDEWHWQJCPN-UHFFFAOYSA-N
XLogP3.67
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500437.84
LogP ≤ 53.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

3-Bromo-2,6-dimethylpyridine
CID 603971
3,5-Dibromo-4-chloro-2,6-dimethylpyridine
CID 3589112
2,4-Dibromo-6-methylpyridine
CID 12643720
4-Bromo-2,6-dimethylpyridine
CID 13081735
2,3,5-Tribromo-4,6-dimethylpyridine
CID 253291
6-Bromo-3-iodo-2-methylpyridine
CID 45588151
4-Bromo-2-fluoro-6-methylpyridine
CID 70701055
3,6-Dibromo-2-ethylpyridine
CID 73554373
4-Bromo-3-fluoro-2,6-dimethylpyridine
CID 73554897
3-Bromo-2-iodo-6-methylpyridine
CID 129948815
2,3,5-Tribromo-6-methylpyridine
CID 548487
4-Bromo-2,6-bis(bromomethyl)pyridine
CID 642807

Frequently Asked Questions

What is the IUPAC name of 4-bromo-3,5-diiodo-2,6-dimethylpyridine?
The IUPAC name of 4-bromo-3,5-diiodo-2,6-dimethylpyridine (CID 84819921) is 4-bromo-3,5-diiodo-2,6-dimethylpyridine.
What is the SMILES notation for 4-bromo-3,5-diiodo-2,6-dimethylpyridine?
The canonical SMILES for 4-bromo-3,5-diiodo-2,6-dimethylpyridine is Cc1nc(C)c(I)c(Br)c1I.
What is the InChIKey of 4-bromo-3,5-diiodo-2,6-dimethylpyridine?
The InChIKey is GPNCDEWHWQJCPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6BrI2N/c1-3-6(9)5(8)7(10)4(2)11-3/h1-2H3.
What are the key properties of 4-bromo-3,5-diiodo-2,6-dimethylpyridine?
4-bromo-3,5-diiodo-2,6-dimethylpyridine has a molecular weight of 437.84 g/mol, XLogP of 3.67, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-3,5-diiodo-2,6-dimethylpyridine is sourced from PubChem (CID 84819921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).