[1,2]oxazolo[4,5-b]pyridine

C6H4N2O — CID 22169820

IUPAC[1,2]oxazolo[4,5-b]pyridine
SMILESc1cnc2cnoc2c1
InChIInChI=1S/C6H4N2O/c1-2-6-5(7-3-1)4-8-9-6/h1-4H
InChIKeyXUTIDUCSRSNKKP-UHFFFAOYSA-N
MW120.11 g/mol
LogP1.22
Rot. Bonds

About [1,2]oxazolo[4,5-b]pyridine

[1,2]oxazolo[4,5-b]pyridine (PubChem CID 22169820) has the molecular formula C6H4N2O and a molecular weight of 120.11 g/mol. Its IUPAC name is [1,2]oxazolo[4,5-b]pyridine.

Molecular Properties

Compound Name[1,2]oxazolo[4,5-b]pyridine
PubChem CID22169820
Molecular FormulaC6H4N2O
Molecular Weight120.11 g/mol
Exact Mass120.03
IUPAC Name[1,2]oxazolo[4,5-b]pyridine
SMILESc1cnc2cnoc2c1
InChIInChI=1S/C6H4N2O/c1-2-6-5(7-3-1)4-8-9-6/h1-4H
InChIKeyXUTIDUCSRSNKKP-UHFFFAOYSA-N
XLogP1.22
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500120.11
LogP ≤ 51.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [1,2]oxazolo[4,5-b]pyridine?
The IUPAC name of [1,2]oxazolo[4,5-b]pyridine (CID 22169820) is [1,2]oxazolo[4,5-b]pyridine.
What is the SMILES notation for [1,2]oxazolo[4,5-b]pyridine?
The canonical SMILES for [1,2]oxazolo[4,5-b]pyridine is c1cnc2cnoc2c1.
What is the InChIKey of [1,2]oxazolo[4,5-b]pyridine?
The InChIKey is XUTIDUCSRSNKKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4N2O/c1-2-6-5(7-3-1)4-8-9-6/h1-4H.
What are the key properties of [1,2]oxazolo[4,5-b]pyridine?
[1,2]oxazolo[4,5-b]pyridine has a molecular weight of 120.11 g/mol, XLogP of 1.22, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1,2]oxazolo[4,5-b]pyridine is sourced from PubChem (CID 22169820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).