3-bromo-4-(4-iodophenoxy)pyridine

C11H7BrINO — CID 104776662

IUPAC3-bromo-4-(4-iodophenoxy)pyridine
SMILESBrc1cnccc1Oc1ccc(I)cc1
InChIInChI=1S/C11H7BrINO/c12-10-7-14-6-5-11(10)15-9-3-1-8(13)2-4-9/h1-7H
InChIKeyAJWMLKYRZBTFFI-UHFFFAOYSA-N
MW375.99 g/mol
LogP4.24
Rot. Bonds2

About 3-bromo-4-(4-iodophenoxy)pyridine

3-bromo-4-(4-iodophenoxy)pyridine (PubChem CID 104776662) has the molecular formula C11H7BrINO and a molecular weight of 375.99 g/mol. Its IUPAC name is 3-bromo-4-(4-iodophenoxy)pyridine.

Molecular Properties

Compound Name3-bromo-4-(4-iodophenoxy)pyridine
PubChem CID104776662
Molecular FormulaC11H7BrINO
Molecular Weight375.99 g/mol
Exact Mass374.88
IUPAC Name3-bromo-4-(4-iodophenoxy)pyridine
SMILESBrc1cnccc1Oc1ccc(I)cc1
InChIInChI=1S/C11H7BrINO/c12-10-7-14-6-5-11(10)15-9-3-1-8(13)2-4-9/h1-7H
InChIKeyAJWMLKYRZBTFFI-UHFFFAOYSA-N
XLogP4.24
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.99
LogP ≤ 54.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-(4-Bromophenoxy)-pyridine
CID 12673495
5-Bromo-2-methoxypyridine
CID 2734895
4-Bromo-2-methoxypyridine
CID 14062309
2-Phenoxypyridine
CID 78510
4-Phenoxypyridine
CID 249651
3-Bromo-2-ethoxypyridine
CID 10987308
2-Benzyloxy-5-bromopyridine
CID 11108191
3-Bromo-2-methoxypyridine
CID 12533390
2-(2-Bromophenoxy)pyridine
CID 13169698
2-Benzyloxy-3-bromopyridine
CID 14712456
2-(4-Bromophenoxy)pyridine
CID 23201935
2-(4-Bromophenoxy)-5-(trifluoromethyl)pyridine
CID 2822057

Frequently Asked Questions

What is the IUPAC name of 3-bromo-4-(4-iodophenoxy)pyridine?
The IUPAC name of 3-bromo-4-(4-iodophenoxy)pyridine (CID 104776662) is 3-bromo-4-(4-iodophenoxy)pyridine.
What is the SMILES notation for 3-bromo-4-(4-iodophenoxy)pyridine?
The canonical SMILES for 3-bromo-4-(4-iodophenoxy)pyridine is Brc1cnccc1Oc1ccc(I)cc1.
What is the InChIKey of 3-bromo-4-(4-iodophenoxy)pyridine?
The InChIKey is AJWMLKYRZBTFFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7BrINO/c12-10-7-14-6-5-11(10)15-9-3-1-8(13)2-4-9/h1-7H.
What are the key properties of 3-bromo-4-(4-iodophenoxy)pyridine?
3-bromo-4-(4-iodophenoxy)pyridine has a molecular weight of 375.99 g/mol, XLogP of 4.24, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-4-(4-iodophenoxy)pyridine is sourced from PubChem (CID 104776662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).