4-(dibromomethyl)-3-iodopyridine

C6H4Br2IN — CID 133063064

IUPAC4-(dibromomethyl)-3-iodopyridine
SMILESBrC(Br)c1ccncc1I
InChIInChI=1S/C6H4Br2IN/c7-6(8)4-1-2-10-3-5(4)9/h1-3,6H
InChIKeyFEXFESUQRXACPR-UHFFFAOYSA-N
MW376.82 g/mol
LogP3.47
Rot. Bonds1

About 4-(dibromomethyl)-3-iodopyridine

4-(dibromomethyl)-3-iodopyridine (PubChem CID 133063064) has the molecular formula C6H4Br2IN and a molecular weight of 376.82 g/mol. Its IUPAC name is 4-(dibromomethyl)-3-iodopyridine.

Molecular Properties

Compound Name4-(dibromomethyl)-3-iodopyridine
PubChem CID133063064
Molecular FormulaC6H4Br2IN
Molecular Weight376.82 g/mol
Exact Mass374.78
IUPAC Name4-(dibromomethyl)-3-iodopyridine
SMILESBrC(Br)c1ccncc1I
InChIInChI=1S/C6H4Br2IN/c7-6(8)4-1-2-10-3-5(4)9/h1-3,6H
InChIKeyFEXFESUQRXACPR-UHFFFAOYSA-N
XLogP3.47
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.82
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

4-(3,3-dimethylbutan-2-yl)-3-iodopyridine
CID 170214211
3-[(1R)-1-bromoethyl]-4-methylpyridine
CID 124706368
4-(3-bromobutan-2-yl)-3-fluoropyridine
CID 104738939
4-bromo-3-(1-bromoethyl)pyridine
CID 119087167
(4-iodo-3-pyridinyl)methanol
CID 119092620
3-iodo-4-piperidin-1-ylpyridine
CID 45033786
4-iodopyridine-3-carboxylic acid
CID 818279
3-tert-butyl-4-propan-2-ylpyridine
CID 59734411
4-(1-fluoroethyl)pyridine-3-carbonitrile
CID 91089599
4-[(1S,2S)-1,2-dibromo-2-pyridin-4-ylethyl]pyridine
CID 129396706
1-(3-bromo-4-pyridinyl)decan-1-ol
CID 151141391
[2,2-difluoro-1-(3-fluoro-4-pyridinyl)ethyl]hydrazine
CID 105265116

Frequently Asked Questions

What is the IUPAC name of 4-(dibromomethyl)-3-iodopyridine?
The IUPAC name of 4-(dibromomethyl)-3-iodopyridine (CID 133063064) is 4-(dibromomethyl)-3-iodopyridine.
What is the SMILES notation for 4-(dibromomethyl)-3-iodopyridine?
The canonical SMILES for 4-(dibromomethyl)-3-iodopyridine is BrC(Br)c1ccncc1I.
What is the InChIKey of 4-(dibromomethyl)-3-iodopyridine?
The InChIKey is FEXFESUQRXACPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4Br2IN/c7-6(8)4-1-2-10-3-5(4)9/h1-3,6H.
What are the key properties of 4-(dibromomethyl)-3-iodopyridine?
4-(dibromomethyl)-3-iodopyridine has a molecular weight of 376.82 g/mol, XLogP of 3.47, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dibromomethyl)-3-iodopyridine is sourced from PubChem (CID 133063064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).