5-(azetidin-3-yloxymethyl)-1,2-oxazole

C7H10N2O2 — CID 63105327

IUPAC5-(azetidin-3-yloxymethyl)-1,2-oxazole
SMILESc1cc(COC2CNC2)on1
InChIInChI=1S/C7H10N2O2/c1-2-9-11-6(1)5-10-7-3-8-4-7/h1-2,7-8H,3-5H2
InChIKeyZXQQCZKDZITFQF-UHFFFAOYSA-N
MW154.17 g/mol
LogP0.16
Rot. Bonds3

About 5-(azetidin-3-yloxymethyl)-1,2-oxazole

5-(azetidin-3-yloxymethyl)-1,2-oxazole (PubChem CID 63105327) has the molecular formula C7H10N2O2 and a molecular weight of 154.17 g/mol. Its IUPAC name is 5-(azetidin-3-yloxymethyl)-1,2-oxazole.

Molecular Properties

Compound Name5-(azetidin-3-yloxymethyl)-1,2-oxazole
PubChem CID63105327
Molecular FormulaC7H10N2O2
Molecular Weight154.17 g/mol
Exact Mass154.07
IUPAC Name5-(azetidin-3-yloxymethyl)-1,2-oxazole
SMILESc1cc(COC2CNC2)on1
InChIInChI=1S/C7H10N2O2/c1-2-9-11-6(1)5-10-7-3-8-4-7/h1-2,7-8H,3-5H2
InChIKeyZXQQCZKDZITFQF-UHFFFAOYSA-N
XLogP0.16
TPSA47.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.17
LogP ≤ 50.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(azetidin-3-yloxymethyl)-1,2-oxazole?
The IUPAC name of 5-(azetidin-3-yloxymethyl)-1,2-oxazole (CID 63105327) is 5-(azetidin-3-yloxymethyl)-1,2-oxazole.
What is the SMILES notation for 5-(azetidin-3-yloxymethyl)-1,2-oxazole?
The canonical SMILES for 5-(azetidin-3-yloxymethyl)-1,2-oxazole is c1cc(COC2CNC2)on1.
What is the InChIKey of 5-(azetidin-3-yloxymethyl)-1,2-oxazole?
The InChIKey is ZXQQCZKDZITFQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O2/c1-2-9-11-6(1)5-10-7-3-8-4-7/h1-2,7-8H,3-5H2.
What are the key properties of 5-(azetidin-3-yloxymethyl)-1,2-oxazole?
5-(azetidin-3-yloxymethyl)-1,2-oxazole has a molecular weight of 154.17 g/mol, XLogP of 0.16, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(azetidin-3-yloxymethyl)-1,2-oxazole is sourced from PubChem (CID 63105327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).