2-bromo-6-(2-ethylcyclohexyl)oxypyridine

C13H18BrNO — CID 63964037

IUPAC2-bromo-6-(2-ethylcyclohexyl)oxypyridine
SMILESCCC1CCCCC1Oc1cccc(Br)n1
InChIInChI=1S/C13H18BrNO/c1-2-10-6-3-4-7-11(10)16-13-9-5-8-12(14)15-13/h5,8-11H,2-4,6-7H2,1H3
InChIKeyXEXCPVQXHPGZGH-UHFFFAOYSA-N
MW284.20 g/mol
LogP4.19
Rot. Bonds3

About 2-bromo-6-(2-ethylcyclohexyl)oxypyridine

2-bromo-6-(2-ethylcyclohexyl)oxypyridine (PubChem CID 63964037) has the molecular formula C13H18BrNO and a molecular weight of 284.20 g/mol. Its IUPAC name is 2-bromo-6-(2-ethylcyclohexyl)oxypyridine.

Molecular Properties

Compound Name2-bromo-6-(2-ethylcyclohexyl)oxypyridine
PubChem CID63964037
Molecular FormulaC13H18BrNO
Molecular Weight284.20 g/mol
Exact Mass283.06
IUPAC Name2-bromo-6-(2-ethylcyclohexyl)oxypyridine
SMILESCCC1CCCCC1Oc1cccc(Br)n1
InChIInChI=1S/C13H18BrNO/c1-2-10-6-3-4-7-11(10)16-13-9-5-8-12(14)15-13/h5,8-11H,2-4,6-7H2,1H3
InChIKeyXEXCPVQXHPGZGH-UHFFFAOYSA-N
XLogP4.19
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.20
LogP ≤ 54.19
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-(chloromethyl)-6-(2-ethylcyclohexyl)oxypyridine
CID 63446435
N-[[6-(2-ethylcyclohexyl)oxy-2-pyridinyl]methyl]propan-1-amine
CID 62292114
(2-ethylcyclohexyl) 6-bromopyridine-2-carboxylate
CID 103889501
1-bromo-3-(2-ethylcyclohexyl)oxybenzene
CID 63863406
[4-(2-ethylcyclohexyl)oxypyrimidin-2-yl]hydrazine
CID 80909980
6-(2-ethylcyclohexyl)oxy-N-methyl-2-propan-2-ylpyrimidin-4-amine
CID 80966709
2-bromo-6-[(3S,4R)-4-methylpyrrolidin-3-yl]oxypyridine
CID 121284132
1-[2-(2-ethylcyclohexyl)oxy-3-pyridinyl]ethanamine
CID 114056592
2-(bromomethyl)-1-chloro-3-(2-ethylcyclohexyl)oxybenzene
CID 113276992
4-(2-ethylcyclohexyl)oxy-6-methoxy-1,3,5-triazin-2-amine
CID 80858256
2-bromo-5-(2-ethylcyclohexyl)oxy-1,3,4-thiadiazole
CID 64622389
1-[3-bromo-2-(2-ethylcyclohexyl)oxyphenyl]butan-2-amine
CID 63862926

Frequently Asked Questions

What is the IUPAC name of 2-bromo-6-(2-ethylcyclohexyl)oxypyridine?
The IUPAC name of 2-bromo-6-(2-ethylcyclohexyl)oxypyridine (CID 63964037) is 2-bromo-6-(2-ethylcyclohexyl)oxypyridine.
What is the SMILES notation for 2-bromo-6-(2-ethylcyclohexyl)oxypyridine?
The canonical SMILES for 2-bromo-6-(2-ethylcyclohexyl)oxypyridine is CCC1CCCCC1Oc1cccc(Br)n1.
What is the InChIKey of 2-bromo-6-(2-ethylcyclohexyl)oxypyridine?
The InChIKey is XEXCPVQXHPGZGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18BrNO/c1-2-10-6-3-4-7-11(10)16-13-9-5-8-12(14)15-13/h5,8-11H,2-4,6-7H2,1H3.
What are the key properties of 2-bromo-6-(2-ethylcyclohexyl)oxypyridine?
2-bromo-6-(2-ethylcyclohexyl)oxypyridine has a molecular weight of 284.20 g/mol, XLogP of 4.19, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-6-(2-ethylcyclohexyl)oxypyridine is sourced from PubChem (CID 63964037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).