2-bromo-6-ethoxypyridine

C7H8BrNO — CID 1201018

IUPAC2-bromo-6-ethoxypyridine
SMILESCCOc1cccc(Br)n1
InChIInChI=1S/C7H8BrNO/c1-2-10-7-5-3-4-6(8)9-7/h3-5H,2H2,1H3
InChIKeyUOYDOTUNXZKLMI-UHFFFAOYSA-N
MW202.05 g/mol
LogP2.24
Rot. Bonds2

About 2-bromo-6-ethoxypyridine

2-bromo-6-ethoxypyridine (PubChem CID 1201018) has the molecular formula C7H8BrNO and a molecular weight of 202.05 g/mol. Its IUPAC name is 2-bromo-6-ethoxypyridine.

Molecular Properties

Compound Name2-bromo-6-ethoxypyridine
PubChem CID1201018
Molecular FormulaC7H8BrNO
Molecular Weight202.05 g/mol
Exact Mass200.98
IUPAC Name2-bromo-6-ethoxypyridine
SMILESCCOc1cccc(Br)n1
InChIInChI=1S/C7H8BrNO/c1-2-10-7-5-3-4-6(8)9-7/h3-5H,2H2,1H3
InChIKeyUOYDOTUNXZKLMI-UHFFFAOYSA-N
XLogP2.24
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.05
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-Ethoxypyridine
CID 84499
2-Chloro-6-ethoxypyridine
CID 98563
2-Bromo-6-methoxypyridine
CID 256810
2,6-Dimethoxypyridine
CID 80378
Butyl 2-pyridyl ether
CID 95701
5-Bromo-2-methoxypyridine
CID 2734895
2-((6-Bromopyridin-2-yl)oxy)-N,N-dimethylethan-1-amine
CID 46233349
3-Bromo-2,6-dimethoxypyridine
CID 642860
5-Bromo-2-ethoxypyridine
CID 817237
2-Methoxy-6-(tributylstannyl)pyridine
CID 10524891
3-Bromo-6-methoxy-2-methylpyridine
CID 10798146
3-Bromo-2-ethoxypyridine
CID 10987308

Frequently Asked Questions

What is the IUPAC name of 2-bromo-6-ethoxypyridine?
The IUPAC name of 2-bromo-6-ethoxypyridine (CID 1201018) is 2-bromo-6-ethoxypyridine.
What is the SMILES notation for 2-bromo-6-ethoxypyridine?
The canonical SMILES for 2-bromo-6-ethoxypyridine is CCOc1cccc(Br)n1.
What is the InChIKey of 2-bromo-6-ethoxypyridine?
The InChIKey is UOYDOTUNXZKLMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8BrNO/c1-2-10-7-5-3-4-6(8)9-7/h3-5H,2H2,1H3.
What are the key properties of 2-bromo-6-ethoxypyridine?
2-bromo-6-ethoxypyridine has a molecular weight of 202.05 g/mol, XLogP of 2.24, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-6-ethoxypyridine is sourced from PubChem (CID 1201018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).