3-bromo-5-chloro-2-(oxolan-2-ylmethoxy)pyridine

C10H11BrClNO2 — CID 114837569

IUPAC3-bromo-5-chloro-2-(oxolan-2-ylmethoxy)pyridine
SMILESClc1cnc(OCC2CCCO2)c(Br)c1
InChIInChI=1S/C10H11BrClNO2/c11-9-4-7(12)5-13-10(9)15-6-8-2-1-3-14-8/h4-5,8H,1-3,6H2
InChIKeyDHIPAHDXHXENQG-UHFFFAOYSA-N
MW292.56 g/mol
LogP3.06
Rot. Bonds3

About 3-bromo-5-chloro-2-(oxolan-2-ylmethoxy)pyridine

3-bromo-5-chloro-2-(oxolan-2-ylmethoxy)pyridine (PubChem CID 114837569) has the molecular formula C10H11BrClNO2 and a molecular weight of 292.56 g/mol. Its IUPAC name is 3-bromo-5-chloro-2-(oxolan-2-ylmethoxy)pyridine.

Molecular Properties

Compound Name3-bromo-5-chloro-2-(oxolan-2-ylmethoxy)pyridine
PubChem CID114837569
Molecular FormulaC10H11BrClNO2
Molecular Weight292.56 g/mol
Exact Mass290.97
IUPAC Name3-bromo-5-chloro-2-(oxolan-2-ylmethoxy)pyridine
SMILESClc1cnc(OCC2CCCO2)c(Br)c1
InChIInChI=1S/C10H11BrClNO2/c11-9-4-7(12)5-13-10(9)15-6-8-2-1-3-14-8/h4-5,8H,1-3,6H2
InChIKeyDHIPAHDXHXENQG-UHFFFAOYSA-N
XLogP3.06
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
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

5-chloro-3-fluoro-2-(oxolan-2-ylmethoxy)pyridine
CID 79728314
3-bromo-5-chloro-2-(cyclopentylmethoxy)pyridine
CID 114837797
3-bromo-5-chloro-2-(cyclopropylmethoxy)pyridine
CID 114837615
3-bromo-5-chloro-2-(oxan-4-ylmethoxy)pyridine
CID 114837736
5-bromo-2-(oxolan-2-ylmethoxy)pyridin-3-amine
CID 61228294
3-chloro-5-(chloromethyl)-2-(oxan-2-ylmethoxy)pyridine
CID 61258069
3-bromo-5-chloro-N-ethyl-N-(oxolan-2-ylmethyl)pyridin-2-amine
CID 114836813
N-[[5-bromo-2-(oxolan-2-ylmethoxy)-3-pyridinyl]methyl]ethanamine
CID 62292146
2-[(2,4,5-trichlorophenoxy)methyl]oxolane
CID 112779327
2-bromo-5-(oxolan-2-ylmethoxy)pyridine
CID 104853752
3-chloro-4,5-dimethyl-6-(oxolan-2-ylmethoxy)pyridazine
CID 63271996
2-chloro-5-fluoro-4-(oxan-2-ylmethoxy)pyrimidine
CID 79081513

Frequently Asked Questions

What is the IUPAC name of 3-bromo-5-chloro-2-(oxolan-2-ylmethoxy)pyridine?
The IUPAC name of 3-bromo-5-chloro-2-(oxolan-2-ylmethoxy)pyridine (CID 114837569) is 3-bromo-5-chloro-2-(oxolan-2-ylmethoxy)pyridine.
What is the SMILES notation for 3-bromo-5-chloro-2-(oxolan-2-ylmethoxy)pyridine?
The canonical SMILES for 3-bromo-5-chloro-2-(oxolan-2-ylmethoxy)pyridine is Clc1cnc(OCC2CCCO2)c(Br)c1.
What is the InChIKey of 3-bromo-5-chloro-2-(oxolan-2-ylmethoxy)pyridine?
The InChIKey is DHIPAHDXHXENQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11BrClNO2/c11-9-4-7(12)5-13-10(9)15-6-8-2-1-3-14-8/h4-5,8H,1-3,6H2.
What are the key properties of 3-bromo-5-chloro-2-(oxolan-2-ylmethoxy)pyridine?
3-bromo-5-chloro-2-(oxolan-2-ylmethoxy)pyridine has a molecular weight of 292.56 g/mol, XLogP of 3.06, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-5-chloro-2-(oxolan-2-ylmethoxy)pyridine is sourced from PubChem (CID 114837569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).