2-(azetidin-3-yloxy)-3-bromo-5-chloropyridine

C8H8BrClN2O — CID 114838242

IUPAC2-(azetidin-3-yloxy)-3-bromo-5-chloropyridine
SMILESClc1cnc(OC2CNC2)c(Br)c1
InChIInChI=1S/C8H8BrClN2O/c9-7-1-5(10)2-12-8(7)13-6-3-11-4-6/h1-2,6,11H,3-4H2
InChIKeyUDQKGCARQGYQED-UHFFFAOYSA-N
MW263.52 g/mol
LogP1.85
Rot. Bonds2

About 2-(azetidin-3-yloxy)-3-bromo-5-chloropyridine

2-(azetidin-3-yloxy)-3-bromo-5-chloropyridine (PubChem CID 114838242) has the molecular formula C8H8BrClN2O and a molecular weight of 263.52 g/mol. Its IUPAC name is 2-(azetidin-3-yloxy)-3-bromo-5-chloropyridine.

Molecular Properties

Compound Name2-(azetidin-3-yloxy)-3-bromo-5-chloropyridine
PubChem CID114838242
Molecular FormulaC8H8BrClN2O
Molecular Weight263.52 g/mol
Exact Mass261.95
IUPAC Name2-(azetidin-3-yloxy)-3-bromo-5-chloropyridine
SMILESClc1cnc(OC2CNC2)c(Br)c1
InChIInChI=1S/C8H8BrClN2O/c9-7-1-5(10)2-12-8(7)13-6-3-11-4-6/h1-2,6,11H,3-4H2
InChIKeyUDQKGCARQGYQED-UHFFFAOYSA-N
XLogP1.85
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.52
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(azetidin-3-yloxy)-4-bromo-6-chloro-2,7-naphthyridine
CID 165117927
[3-[(3-bromo-5-chloro-2-pyridinyl)oxy]cyclobutyl]methanamine
CID 114838257
2-(azetidin-3-yloxy)-3-bromopyridine
CID 58547749
2-[(3-bromo-5-chloro-2-pyridinyl)oxymethyl]-6-methylmorpholine
CID 102635416
3-bromo-5-chloro-2-(3-methoxycyclohexyl)oxypyridine
CID 114837770
3,5-dichloro-2-pyrrolidin-3-yloxypyridine
CID 62347674
3-bromo-5-methyl-2-pyrrolidin-3-yloxypyridine
CID 105368575
3-bromo-5-chloro-2-(cyclopropylmethoxy)pyridine
CID 114837615
3-bromo-5-chloro-2-(oxan-4-ylmethoxy)pyridine
CID 114837736
3-bromo-5-chloro-2-(cyclopentylmethoxy)pyridine
CID 114837797
3-(azetidin-3-yloxy)-5-chloro-2-phenylmethoxypyridine
CID 58405049
3-bromo-5-nitro-2-[(3S)-piperidin-3-yl]oxypyridine
CID 79523632

Frequently Asked Questions

What is the IUPAC name of 2-(azetidin-3-yloxy)-3-bromo-5-chloropyridine?
The IUPAC name of 2-(azetidin-3-yloxy)-3-bromo-5-chloropyridine (CID 114838242) is 2-(azetidin-3-yloxy)-3-bromo-5-chloropyridine.
What is the SMILES notation for 2-(azetidin-3-yloxy)-3-bromo-5-chloropyridine?
The canonical SMILES for 2-(azetidin-3-yloxy)-3-bromo-5-chloropyridine is Clc1cnc(OC2CNC2)c(Br)c1.
What is the InChIKey of 2-(azetidin-3-yloxy)-3-bromo-5-chloropyridine?
The InChIKey is UDQKGCARQGYQED-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8BrClN2O/c9-7-1-5(10)2-12-8(7)13-6-3-11-4-6/h1-2,6,11H,3-4H2.
What are the key properties of 2-(azetidin-3-yloxy)-3-bromo-5-chloropyridine?
2-(azetidin-3-yloxy)-3-bromo-5-chloropyridine has a molecular weight of 263.52 g/mol, XLogP of 1.85, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azetidin-3-yloxy)-3-bromo-5-chloropyridine is sourced from PubChem (CID 114838242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).