1-(2-morpholin-4-ylethyl)-[1,3]oxazolo[5,4-b]pyridin-2-one

C12H15N3O3 — CID 10037683

IUPAC1-(2-morpholin-4-ylethyl)-[1,3]oxazolo[5,4-b]pyridin-2-one
SMILESO=c1oc2ncccc2n1CCN1CCOCC1
InChIInChI=1S/C12H15N3O3/c16-12-15(5-4-14-6-8-17-9-7-14)10-2-1-3-13-11(10)18-12/h1-3H,4-9H2
InChIKeyWMBKNLQADCJVTB-UHFFFAOYSA-N
MW249.27 g/mol
LogP0.32
Rot. Bonds3

About 1-(2-morpholin-4-ylethyl)-[1,3]oxazolo[5,4-b]pyridin-2-one

1-(2-morpholin-4-ylethyl)-[1,3]oxazolo[5,4-b]pyridin-2-one (PubChem CID 10037683) has the molecular formula C12H15N3O3 and a molecular weight of 249.27 g/mol. Its IUPAC name is 1-(2-morpholin-4-ylethyl)-[1,3]oxazolo[5,4-b]pyridin-2-one.

Molecular Properties

Compound Name1-(2-morpholin-4-ylethyl)-[1,3]oxazolo[5,4-b]pyridin-2-one
PubChem CID10037683
Molecular FormulaC12H15N3O3
Molecular Weight249.27 g/mol
Exact Mass249.11
IUPAC Name1-(2-morpholin-4-ylethyl)-[1,3]oxazolo[5,4-b]pyridin-2-one
SMILESO=c1oc2ncccc2n1CCN1CCOCC1
InChIInChI=1S/C12H15N3O3/c16-12-15(5-4-14-6-8-17-9-7-14)10-2-1-3-13-11(10)18-12/h1-3H,4-9H2
InChIKeyWMBKNLQADCJVTB-UHFFFAOYSA-N
XLogP0.32
TPSA60.50 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.27
LogP ≤ 50.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-(2-morpholin-4-ylethyl)-[1,3]oxazolo[5,4-b]pyridin-2-one?
The IUPAC name of 1-(2-morpholin-4-ylethyl)-[1,3]oxazolo[5,4-b]pyridin-2-one (CID 10037683) is 1-(2-morpholin-4-ylethyl)-[1,3]oxazolo[5,4-b]pyridin-2-one.
What is the SMILES notation for 1-(2-morpholin-4-ylethyl)-[1,3]oxazolo[5,4-b]pyridin-2-one?
The canonical SMILES for 1-(2-morpholin-4-ylethyl)-[1,3]oxazolo[5,4-b]pyridin-2-one is O=c1oc2ncccc2n1CCN1CCOCC1.
What is the InChIKey of 1-(2-morpholin-4-ylethyl)-[1,3]oxazolo[5,4-b]pyridin-2-one?
The InChIKey is WMBKNLQADCJVTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O3/c16-12-15(5-4-14-6-8-17-9-7-14)10-2-1-3-13-11(10)18-12/h1-3H,4-9H2.
What are the key properties of 1-(2-morpholin-4-ylethyl)-[1,3]oxazolo[5,4-b]pyridin-2-one?
1-(2-morpholin-4-ylethyl)-[1,3]oxazolo[5,4-b]pyridin-2-one has a molecular weight of 249.27 g/mol, XLogP of 0.32, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-morpholin-4-ylethyl)-[1,3]oxazolo[5,4-b]pyridin-2-one is sourced from PubChem (CID 10037683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).