4-bromo-3-chloro-2-(oxan-4-yloxy)pyridine

C10H11BrClNO2 — CID 134183071

IUPAC4-bromo-3-chloro-2-(oxan-4-yloxy)pyridine
SMILESClc1c(Br)ccnc1OC1CCOCC1
InChIInChI=1S/C10H11BrClNO2/c11-8-1-4-13-10(9(8)12)15-7-2-5-14-6-3-7/h1,4,7H,2-3,5-6H2
InChIKeyCHLRYMSYZYBUOV-UHFFFAOYSA-N
MW292.56 g/mol
LogP3.06
Rot. Bonds2

About 4-bromo-3-chloro-2-(oxan-4-yloxy)pyridine

4-bromo-3-chloro-2-(oxan-4-yloxy)pyridine (PubChem CID 134183071) has the molecular formula C10H11BrClNO2 and a molecular weight of 292.56 g/mol. Its IUPAC name is 4-bromo-3-chloro-2-(oxan-4-yloxy)pyridine.

Molecular Properties

Compound Name4-bromo-3-chloro-2-(oxan-4-yloxy)pyridine
PubChem CID134183071
Molecular FormulaC10H11BrClNO2
Molecular Weight292.56 g/mol
Exact Mass290.97
IUPAC Name4-bromo-3-chloro-2-(oxan-4-yloxy)pyridine
SMILESClc1c(Br)ccnc1OC1CCOCC1
InChIInChI=1S/C10H11BrClNO2/c11-8-1-4-13-10(9(8)12)15-7-2-5-14-6-3-7/h1,4,7H,2-3,5-6H2
InChIKeyCHLRYMSYZYBUOV-UHFFFAOYSA-N
XLogP3.06
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.56
LogP ≤ 53.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2,3-dichloro-4-[3-chloro-4-(oxan-4-yloxy)phenyl]pyridine
CID 87150314
3-methyl-4-(oxan-4-yloxy)-2H-pyrazolo[4,3-c]pyridine
CID 59618824
6-chloro-2-(oxan-4-yloxy)pyridin-3-amine
CID 115474519
3-bromo-5-chloro-2-(oxan-4-ylmethoxy)pyridine
CID 114837736
5-bromo-3-(chloromethyl)-2-(oxan-4-yloxy)pyridine
CID 62001160
3-chloro-6-(oxan-4-yloxy)pyridazine
CID 53256682
5-chloro-2-(2-fluoro-4-pyridinyl)-4-(oxan-4-yloxy)-1H-pyrimidin-6-one
CID 134382660
N-[[3-fluoro-2-(oxan-4-yloxy)-4-pyridinyl]methyl]ethanamine
CID 105390729
4-chloro-8-cyclopropyloxy-1,7-naphthyridine
CID 177053142
3-bromo-2-(4-methylcyclohexyl)oxypyridine
CID 61373555
4-[2,6-dibromo-4-(chloromethyl)phenoxy]oxane
CID 107745321
3-chloro-2-fluoro-6-(oxan-4-yloxy)pyridine
CID 125116478

Frequently Asked Questions

What is the IUPAC name of 4-bromo-3-chloro-2-(oxan-4-yloxy)pyridine?
The IUPAC name of 4-bromo-3-chloro-2-(oxan-4-yloxy)pyridine (CID 134183071) is 4-bromo-3-chloro-2-(oxan-4-yloxy)pyridine.
What is the SMILES notation for 4-bromo-3-chloro-2-(oxan-4-yloxy)pyridine?
The canonical SMILES for 4-bromo-3-chloro-2-(oxan-4-yloxy)pyridine is Clc1c(Br)ccnc1OC1CCOCC1.
What is the InChIKey of 4-bromo-3-chloro-2-(oxan-4-yloxy)pyridine?
The InChIKey is CHLRYMSYZYBUOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11BrClNO2/c11-8-1-4-13-10(9(8)12)15-7-2-5-14-6-3-7/h1,4,7H,2-3,5-6H2.
What are the key properties of 4-bromo-3-chloro-2-(oxan-4-yloxy)pyridine?
4-bromo-3-chloro-2-(oxan-4-yloxy)pyridine has a molecular weight of 292.56 g/mol, XLogP of 3.06, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-3-chloro-2-(oxan-4-yloxy)pyridine is sourced from PubChem (CID 134183071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).