2-morpholin-4-yl-1,3-benzoxazol-6-ol

C11H12N2O3 — CID 146454135

IUPAC2-morpholin-4-yl-1,3-benzoxazol-6-ol
SMILESOc1ccc2nc(N3CCOCC3)oc2c1
InChIInChI=1S/C11H12N2O3/c14-8-1-2-9-10(7-8)16-11(12-9)13-3-5-15-6-4-13/h1-2,7,14H,3-6H2
InChIKeyMKZICKYFLVYGNI-UHFFFAOYSA-N
MW220.23 g/mol
LogP1.37
Rot. Bonds1

About 2-morpholin-4-yl-1,3-benzoxazol-6-ol

2-morpholin-4-yl-1,3-benzoxazol-6-ol (PubChem CID 146454135) has the molecular formula C11H12N2O3 and a molecular weight of 220.23 g/mol. Its IUPAC name is 2-morpholin-4-yl-1,3-benzoxazol-6-ol.

Molecular Properties

Compound Name2-morpholin-4-yl-1,3-benzoxazol-6-ol
PubChem CID146454135
Molecular FormulaC11H12N2O3
Molecular Weight220.23 g/mol
Exact Mass220.08
IUPAC Name2-morpholin-4-yl-1,3-benzoxazol-6-ol
SMILESOc1ccc2nc(N3CCOCC3)oc2c1
InChIInChI=1S/C11H12N2O3/c14-8-1-2-9-10(7-8)16-11(12-9)13-3-5-15-6-4-13/h1-2,7,14H,3-6H2
InChIKeyMKZICKYFLVYGNI-UHFFFAOYSA-N
XLogP1.37
TPSA58.73 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.23
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-morpholin-4-yl-1,3-benzoxazol-6-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-morpholin-4-yl-1,3-benzoxazol-6-ol?
The IUPAC name of 2-morpholin-4-yl-1,3-benzoxazol-6-ol (CID 146454135) is 2-morpholin-4-yl-1,3-benzoxazol-6-ol.
What is the SMILES notation for 2-morpholin-4-yl-1,3-benzoxazol-6-ol?
The canonical SMILES for 2-morpholin-4-yl-1,3-benzoxazol-6-ol is Oc1ccc2nc(N3CCOCC3)oc2c1.
What is the InChIKey of 2-morpholin-4-yl-1,3-benzoxazol-6-ol?
The InChIKey is MKZICKYFLVYGNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O3/c14-8-1-2-9-10(7-8)16-11(12-9)13-3-5-15-6-4-13/h1-2,7,14H,3-6H2.
What are the key properties of 2-morpholin-4-yl-1,3-benzoxazol-6-ol?
2-morpholin-4-yl-1,3-benzoxazol-6-ol has a molecular weight of 220.23 g/mol, XLogP of 1.37, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-yl-1,3-benzoxazol-6-ol is sourced from PubChem (CID 146454135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).