3-methoxy-3,8a-dihydro-2H-[1,3]oxazolo[3,2-a]pyridine

C8H11NO2 — CID 142287670

IUPAC3-methoxy-3,8a-dihydro-2H-[1,3]oxazolo[3,2-a]pyridine
SMILESCOC1COC2C=CC=CN21
InChIInChI=1S/C8H11NO2/c1-10-8-6-11-7-4-2-3-5-9(7)8/h2-5,7-8H,6H2,1H3
InChIKeyUUAKVDUXGZMOHW-UHFFFAOYSA-N
MW153.18 g/mol
LogP0.70
Rot. Bonds1

About 3-methoxy-3,8a-dihydro-2H-[1,3]oxazolo[3,2-a]pyridine

3-methoxy-3,8a-dihydro-2H-[1,3]oxazolo[3,2-a]pyridine (PubChem CID 142287670) has the molecular formula C8H11NO2 and a molecular weight of 153.18 g/mol. Its IUPAC name is 3-methoxy-3,8a-dihydro-2H-[1,3]oxazolo[3,2-a]pyridine.

Molecular Properties

Compound Name3-methoxy-3,8a-dihydro-2H-[1,3]oxazolo[3,2-a]pyridine
PubChem CID142287670
Molecular FormulaC8H11NO2
Molecular Weight153.18 g/mol
Exact Mass153.08
IUPAC Name3-methoxy-3,8a-dihydro-2H-[1,3]oxazolo[3,2-a]pyridine
SMILESCOC1COC2C=CC=CN21
InChIInChI=1S/C8H11NO2/c1-10-8-6-11-7-4-2-3-5-9(7)8/h2-5,7-8H,6H2,1H3
InChIKeyUUAKVDUXGZMOHW-UHFFFAOYSA-N
XLogP0.70
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.18
LogP ≤ 50.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-methoxy-3,8a-dihydro-2H-[1,3]oxazolo[3,2-a]pyridine?
The IUPAC name of 3-methoxy-3,8a-dihydro-2H-[1,3]oxazolo[3,2-a]pyridine (CID 142287670) is 3-methoxy-3,8a-dihydro-2H-[1,3]oxazolo[3,2-a]pyridine.
What is the SMILES notation for 3-methoxy-3,8a-dihydro-2H-[1,3]oxazolo[3,2-a]pyridine?
The canonical SMILES for 3-methoxy-3,8a-dihydro-2H-[1,3]oxazolo[3,2-a]pyridine is COC1COC2C=CC=CN21.
What is the InChIKey of 3-methoxy-3,8a-dihydro-2H-[1,3]oxazolo[3,2-a]pyridine?
The InChIKey is UUAKVDUXGZMOHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO2/c1-10-8-6-11-7-4-2-3-5-9(7)8/h2-5,7-8H,6H2,1H3.
What are the key properties of 3-methoxy-3,8a-dihydro-2H-[1,3]oxazolo[3,2-a]pyridine?
3-methoxy-3,8a-dihydro-2H-[1,3]oxazolo[3,2-a]pyridine has a molecular weight of 153.18 g/mol, XLogP of 0.70, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-3,8a-dihydro-2H-[1,3]oxazolo[3,2-a]pyridine is sourced from PubChem (CID 142287670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).