2,6-dimethyl-[1,3]oxazolo[5,4-b]pyridine

C8H8N2O — CID 12531342

IUPAC2,6-dimethyl-[1,3]oxazolo[5,4-b]pyridine
SMILESCc1cnc2oc(C)nc2c1
InChIInChI=1S/C8H8N2O/c1-5-3-7-8(9-4-5)11-6(2)10-7/h3-4H,1-2H3
InChIKeyZHIYOFARTPNEEN-UHFFFAOYSA-N
MW148.16 g/mol
LogP1.84
Rot. Bonds

About 2,6-dimethyl-[1,3]oxazolo[5,4-b]pyridine

2,6-dimethyl-[1,3]oxazolo[5,4-b]pyridine (PubChem CID 12531342) has the molecular formula C8H8N2O and a molecular weight of 148.16 g/mol. Its IUPAC name is 2,6-dimethyl-[1,3]oxazolo[5,4-b]pyridine.

Molecular Properties

Compound Name2,6-dimethyl-[1,3]oxazolo[5,4-b]pyridine
PubChem CID12531342
Molecular FormulaC8H8N2O
Molecular Weight148.16 g/mol
Exact Mass148.06
IUPAC Name2,6-dimethyl-[1,3]oxazolo[5,4-b]pyridine
SMILESCc1cnc2oc(C)nc2c1
InChIInChI=1S/C8H8N2O/c1-5-3-7-8(9-4-5)11-6(2)10-7/h3-4H,1-2H3
InChIKeyZHIYOFARTPNEEN-UHFFFAOYSA-N
XLogP1.84
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.16
LogP ≤ 51.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-[1,3]oxazolo[5,4-b]pyridine?
The IUPAC name of 2,6-dimethyl-[1,3]oxazolo[5,4-b]pyridine (CID 12531342) is 2,6-dimethyl-[1,3]oxazolo[5,4-b]pyridine.
What is the SMILES notation for 2,6-dimethyl-[1,3]oxazolo[5,4-b]pyridine?
The canonical SMILES for 2,6-dimethyl-[1,3]oxazolo[5,4-b]pyridine is Cc1cnc2oc(C)nc2c1.
What is the InChIKey of 2,6-dimethyl-[1,3]oxazolo[5,4-b]pyridine?
The InChIKey is ZHIYOFARTPNEEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2O/c1-5-3-7-8(9-4-5)11-6(2)10-7/h3-4H,1-2H3.
What are the key properties of 2,6-dimethyl-[1,3]oxazolo[5,4-b]pyridine?
2,6-dimethyl-[1,3]oxazolo[5,4-b]pyridine has a molecular weight of 148.16 g/mol, XLogP of 1.84, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-[1,3]oxazolo[5,4-b]pyridine is sourced from PubChem (CID 12531342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).