2-bromo-5-(2-propoxyethoxy)pyridine

C10H14BrNO2 — CID 107396761

IUPAC2-bromo-5-(2-propoxyethoxy)pyridine
SMILESCCCOCCOc1ccc(Br)nc1
InChIInChI=1S/C10H14BrNO2/c1-2-5-13-6-7-14-9-3-4-10(11)12-8-9/h3-4,8H,2,5-7H2,1H3
InChIKeyOCLUNASOKWAARJ-UHFFFAOYSA-N
MW260.13 g/mol
LogP2.65
Rot. Bonds6

About 2-bromo-5-(2-propoxyethoxy)pyridine

2-bromo-5-(2-propoxyethoxy)pyridine (PubChem CID 107396761) has the molecular formula C10H14BrNO2 and a molecular weight of 260.13 g/mol. Its IUPAC name is 2-bromo-5-(2-propoxyethoxy)pyridine.

Molecular Properties

Compound Name2-bromo-5-(2-propoxyethoxy)pyridine
PubChem CID107396761
Molecular FormulaC10H14BrNO2
Molecular Weight260.13 g/mol
Exact Mass259.02
IUPAC Name2-bromo-5-(2-propoxyethoxy)pyridine
SMILESCCCOCCOc1ccc(Br)nc1
InChIInChI=1S/C10H14BrNO2/c1-2-5-13-6-7-14-9-3-4-10(11)12-8-9/h3-4,8H,2,5-7H2,1H3
InChIKeyOCLUNASOKWAARJ-UHFFFAOYSA-N
XLogP2.65
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.13
LogP ≤ 52.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-bromo-5-butoxypyridine
CID 87199523
2-bromo-5-(3-ethoxypropoxy)pyridine
CID 103816245
[5-(2-propoxyethoxy)-2-pyridinyl]methanamine
CID 115487193
2-bromo-5-(3,3-dimethylbutoxy)pyridine
CID 102670859
2-[(6-bromo-3-pyridinyl)oxy]-N-methylethanamine
CID 162753112
(1S)-1-[5-(2-propoxyethoxy)-2-pyridinyl]propan-1-amine
CID 113355207
2-[(6-bromo-3-pyridinyl)oxy]ethanol
CID 86643980
2-bromo-5-(3-chloropropoxy)pyridine
CID 137352816
1-methyl-4-[2-(2-propoxyethoxy)ethoxy]benzene
CID 58462382
dioxido-[4-(2-propoxyethoxy)phenoxy]borane
CID 86756814
2-bromo-5-pent-3-ynoxypyridine
CID 104743964
2-bromo-5-but-3-ynoxypyridine
CID 103864136

Frequently Asked Questions

What is the IUPAC name of 2-bromo-5-(2-propoxyethoxy)pyridine?
The IUPAC name of 2-bromo-5-(2-propoxyethoxy)pyridine (CID 107396761) is 2-bromo-5-(2-propoxyethoxy)pyridine.
What is the SMILES notation for 2-bromo-5-(2-propoxyethoxy)pyridine?
The canonical SMILES for 2-bromo-5-(2-propoxyethoxy)pyridine is CCCOCCOc1ccc(Br)nc1.
What is the InChIKey of 2-bromo-5-(2-propoxyethoxy)pyridine?
The InChIKey is OCLUNASOKWAARJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14BrNO2/c1-2-5-13-6-7-14-9-3-4-10(11)12-8-9/h3-4,8H,2,5-7H2,1H3.
What are the key properties of 2-bromo-5-(2-propoxyethoxy)pyridine?
2-bromo-5-(2-propoxyethoxy)pyridine has a molecular weight of 260.13 g/mol, XLogP of 2.65, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-5-(2-propoxyethoxy)pyridine is sourced from PubChem (CID 107396761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).