2-[(3-hydroxy-2H-pyran-2-yl)oxy]-2H-pyran-3-ol

C10H10O5 — CID 141292094

IUPAC2-[(3-hydroxy-2H-pyran-2-yl)oxy]-2H-pyran-3-ol
SMILESOC1=CC=COC1OC1OC=CC=C1O
InChIInChI=1S/C10H10O5/c11-7-3-1-5-13-9(7)15-10-8(12)4-2-6-14-10/h1-6,9-12H
InChIKeyVYJVIFTYHALTLL-UHFFFAOYSA-N
MW210.19 g/mol
LogP1.63
Rot. Bonds2

About 2-[(3-hydroxy-2H-pyran-2-yl)oxy]-2H-pyran-3-ol

2-[(3-hydroxy-2H-pyran-2-yl)oxy]-2H-pyran-3-ol (PubChem CID 141292094) has the molecular formula C10H10O5 and a molecular weight of 210.19 g/mol. Its IUPAC name is 2-[(3-hydroxy-2H-pyran-2-yl)oxy]-2H-pyran-3-ol.

Molecular Properties

Compound Name2-[(3-hydroxy-2H-pyran-2-yl)oxy]-2H-pyran-3-ol
PubChem CID141292094
Molecular FormulaC10H10O5
Molecular Weight210.19 g/mol
Exact Mass210.05
IUPAC Name2-[(3-hydroxy-2H-pyran-2-yl)oxy]-2H-pyran-3-ol
SMILESOC1=CC=COC1OC1OC=CC=C1O
InChIInChI=1S/C10H10O5/c11-7-3-1-5-13-9(7)15-10-8(12)4-2-6-14-10/h1-6,9-12H
InChIKeyVYJVIFTYHALTLL-UHFFFAOYSA-N
XLogP1.63
TPSA68.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.19
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-[(3-hydroxy-2H-pyran-2-yl)oxy]-2H-pyran-3-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-[(3-hydroxy-2H-pyran-2-yl)oxy]-2H-pyran-3-ol?
The IUPAC name of 2-[(3-hydroxy-2H-pyran-2-yl)oxy]-2H-pyran-3-ol (CID 141292094) is 2-[(3-hydroxy-2H-pyran-2-yl)oxy]-2H-pyran-3-ol.
What is the SMILES notation for 2-[(3-hydroxy-2H-pyran-2-yl)oxy]-2H-pyran-3-ol?
The canonical SMILES for 2-[(3-hydroxy-2H-pyran-2-yl)oxy]-2H-pyran-3-ol is OC1=CC=COC1OC1OC=CC=C1O.
What is the InChIKey of 2-[(3-hydroxy-2H-pyran-2-yl)oxy]-2H-pyran-3-ol?
The InChIKey is VYJVIFTYHALTLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10O5/c11-7-3-1-5-13-9(7)15-10-8(12)4-2-6-14-10/h1-6,9-12H.
What are the key properties of 2-[(3-hydroxy-2H-pyran-2-yl)oxy]-2H-pyran-3-ol?
2-[(3-hydroxy-2H-pyran-2-yl)oxy]-2H-pyran-3-ol has a molecular weight of 210.19 g/mol, XLogP of 1.63, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-hydroxy-2H-pyran-2-yl)oxy]-2H-pyran-3-ol is sourced from PubChem (CID 141292094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).