2-(4-amino-1,2-oxazol-5-yl)-1-benzofuran-4-ol

C11H8N2O3 — CID 136986518

IUPAC2-(4-amino-1,2-oxazol-5-yl)-1-benzofuran-4-ol
SMILESNc1cnoc1-c1cc2c(O)cccc2o1
InChIInChI=1S/C11H8N2O3/c12-7-5-13-16-11(7)10-4-6-8(14)2-1-3-9(6)15-10/h1-5,14H,12H2
InChIKeyOMDOTDZNELRGMF-UHFFFAOYSA-N
MW216.20 g/mol
LogP2.38
Rot. Bonds1

About 2-(4-amino-1,2-oxazol-5-yl)-1-benzofuran-4-ol

2-(4-amino-1,2-oxazol-5-yl)-1-benzofuran-4-ol (PubChem CID 136986518) has the molecular formula C11H8N2O3 and a molecular weight of 216.20 g/mol. Its IUPAC name is 2-(4-amino-1,2-oxazol-5-yl)-1-benzofuran-4-ol.

Molecular Properties

Compound Name2-(4-amino-1,2-oxazol-5-yl)-1-benzofuran-4-ol
PubChem CID136986518
Molecular FormulaC11H8N2O3
Molecular Weight216.20 g/mol
Exact Mass216.05
IUPAC Name2-(4-amino-1,2-oxazol-5-yl)-1-benzofuran-4-ol
SMILESNc1cnoc1-c1cc2c(O)cccc2o1
InChIInChI=1S/C11H8N2O3/c12-7-5-13-16-11(7)10-4-6-8(14)2-1-3-9(6)15-10/h1-5,14H,12H2
InChIKeyOMDOTDZNELRGMF-UHFFFAOYSA-N
XLogP2.38
TPSA85.42 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.20
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-(4-amino-1,2-oxazol-5-yl)-1-benzofuran-4-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(4-amino-1,2-oxazol-5-yl)-1-benzofuran-4-ol?
The IUPAC name of 2-(4-amino-1,2-oxazol-5-yl)-1-benzofuran-4-ol (CID 136986518) is 2-(4-amino-1,2-oxazol-5-yl)-1-benzofuran-4-ol.
What is the SMILES notation for 2-(4-amino-1,2-oxazol-5-yl)-1-benzofuran-4-ol?
The canonical SMILES for 2-(4-amino-1,2-oxazol-5-yl)-1-benzofuran-4-ol is Nc1cnoc1-c1cc2c(O)cccc2o1.
What is the InChIKey of 2-(4-amino-1,2-oxazol-5-yl)-1-benzofuran-4-ol?
The InChIKey is OMDOTDZNELRGMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8N2O3/c12-7-5-13-16-11(7)10-4-6-8(14)2-1-3-9(6)15-10/h1-5,14H,12H2.
What are the key properties of 2-(4-amino-1,2-oxazol-5-yl)-1-benzofuran-4-ol?
2-(4-amino-1,2-oxazol-5-yl)-1-benzofuran-4-ol has a molecular weight of 216.20 g/mol, XLogP of 2.38, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-amino-1,2-oxazol-5-yl)-1-benzofuran-4-ol is sourced from PubChem (CID 136986518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).