4-ethyl-[1,2]oxazolo[4,5-c]pyridine

C8H8N2O — CID 122697261

IUPAC4-ethyl-[1,2]oxazolo[4,5-c]pyridine
SMILESCCc1nccc2oncc12
InChIInChI=1S/C8H8N2O/c1-2-7-6-5-10-11-8(6)3-4-9-7/h3-5H,2H2,1H3
InChIKeyLWZCHHAFVWRHSA-UHFFFAOYSA-N
MW148.16 g/mol
LogP1.79
Rot. Bonds1

About 4-ethyl-[1,2]oxazolo[4,5-c]pyridine

4-ethyl-[1,2]oxazolo[4,5-c]pyridine (PubChem CID 122697261) has the molecular formula C8H8N2O and a molecular weight of 148.16 g/mol. Its IUPAC name is 4-ethyl-[1,2]oxazolo[4,5-c]pyridine.

Molecular Properties

Compound Name4-ethyl-[1,2]oxazolo[4,5-c]pyridine
PubChem CID122697261
Molecular FormulaC8H8N2O
Molecular Weight148.16 g/mol
Exact Mass148.06
IUPAC Name4-ethyl-[1,2]oxazolo[4,5-c]pyridine
SMILESCCc1nccc2oncc12
InChIInChI=1S/C8H8N2O/c1-2-7-6-5-10-11-8(6)3-4-9-7/h3-5H,2H2,1H3
InChIKeyLWZCHHAFVWRHSA-UHFFFAOYSA-N
XLogP1.79
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.16
LogP ≤ 51.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-[1,2]oxazolo[4,5-c]pyridine?
The IUPAC name of 4-ethyl-[1,2]oxazolo[4,5-c]pyridine (CID 122697261) is 4-ethyl-[1,2]oxazolo[4,5-c]pyridine.
What is the SMILES notation for 4-ethyl-[1,2]oxazolo[4,5-c]pyridine?
The canonical SMILES for 4-ethyl-[1,2]oxazolo[4,5-c]pyridine is CCc1nccc2oncc12.
What is the InChIKey of 4-ethyl-[1,2]oxazolo[4,5-c]pyridine?
The InChIKey is LWZCHHAFVWRHSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2O/c1-2-7-6-5-10-11-8(6)3-4-9-7/h3-5H,2H2,1H3.
What are the key properties of 4-ethyl-[1,2]oxazolo[4,5-c]pyridine?
4-ethyl-[1,2]oxazolo[4,5-c]pyridine has a molecular weight of 148.16 g/mol, XLogP of 1.79, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-[1,2]oxazolo[4,5-c]pyridine is sourced from PubChem (CID 122697261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).