5-bromo-2-methoxy-3-phenoxypyridine

C12H10BrNO2 — CID 165374137

IUPAC5-bromo-2-methoxy-3-phenoxypyridine
SMILESCOc1ncc(Br)cc1Oc1ccccc1
InChIInChI=1S/C12H10BrNO2/c1-15-12-11(7-9(13)8-14-12)16-10-5-3-2-4-6-10/h2-8H,1H3
InChIKeyNBWRPQKBYRXOGS-UHFFFAOYSA-N
MW280.12 g/mol
LogP3.64
Rot. Bonds3

About 5-bromo-2-methoxy-3-phenoxypyridine

5-bromo-2-methoxy-3-phenoxypyridine (PubChem CID 165374137) has the molecular formula C12H10BrNO2 and a molecular weight of 280.12 g/mol. Its IUPAC name is 5-bromo-2-methoxy-3-phenoxypyridine.

Molecular Properties

Compound Name5-bromo-2-methoxy-3-phenoxypyridine
PubChem CID165374137
Molecular FormulaC12H10BrNO2
Molecular Weight280.12 g/mol
Exact Mass278.99
IUPAC Name5-bromo-2-methoxy-3-phenoxypyridine
SMILESCOc1ncc(Br)cc1Oc1ccccc1
InChIInChI=1S/C12H10BrNO2/c1-15-12-11(7-9(13)8-14-12)16-10-5-3-2-4-6-10/h2-8H,1H3
InChIKeyNBWRPQKBYRXOGS-UHFFFAOYSA-N
XLogP3.64
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.12
LogP ≤ 53.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-methoxy-3-phenoxypyridine?
The IUPAC name of 5-bromo-2-methoxy-3-phenoxypyridine (CID 165374137) is 5-bromo-2-methoxy-3-phenoxypyridine.
What is the SMILES notation for 5-bromo-2-methoxy-3-phenoxypyridine?
The canonical SMILES for 5-bromo-2-methoxy-3-phenoxypyridine is COc1ncc(Br)cc1Oc1ccccc1.
What is the InChIKey of 5-bromo-2-methoxy-3-phenoxypyridine?
The InChIKey is NBWRPQKBYRXOGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10BrNO2/c1-15-12-11(7-9(13)8-14-12)16-10-5-3-2-4-6-10/h2-8H,1H3.
What are the key properties of 5-bromo-2-methoxy-3-phenoxypyridine?
5-bromo-2-methoxy-3-phenoxypyridine has a molecular weight of 280.12 g/mol, XLogP of 3.64, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-methoxy-3-phenoxypyridine is sourced from PubChem (CID 165374137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).