2-(3-hydroxy-6-methoxy-2-pyridinyl)-6-methoxypyridin-3-ol

C12H12N2O4 — CID 175477358

IUPAC2-(3-hydroxy-6-methoxy-2-pyridinyl)-6-methoxypyridin-3-ol
SMILESCOc1ccc(O)c(-c2nc(OC)ccc2O)n1
InChIInChI=1S/C12H12N2O4/c1-17-9-5-3-7(15)11(13-9)12-8(16)4-6-10(14-12)18-2/h3-6,15-16H,1-2H3
InChIKeyHKXXSLSCUVIYBH-UHFFFAOYSA-N
MW248.24 g/mol
LogP1.57
Rot. Bonds3

About 2-(3-hydroxy-6-methoxy-2-pyridinyl)-6-methoxypyridin-3-ol

2-(3-hydroxy-6-methoxy-2-pyridinyl)-6-methoxypyridin-3-ol (PubChem CID 175477358) has the molecular formula C12H12N2O4 and a molecular weight of 248.24 g/mol. Its IUPAC name is 2-(3-hydroxy-6-methoxy-2-pyridinyl)-6-methoxypyridin-3-ol.

Molecular Properties

Compound Name2-(3-hydroxy-6-methoxy-2-pyridinyl)-6-methoxypyridin-3-ol
PubChem CID175477358
Molecular FormulaC12H12N2O4
Molecular Weight248.24 g/mol
Exact Mass248.08
IUPAC Name2-(3-hydroxy-6-methoxy-2-pyridinyl)-6-methoxypyridin-3-ol
SMILESCOc1ccc(O)c(-c2nc(OC)ccc2O)n1
InChIInChI=1S/C12H12N2O4/c1-17-9-5-3-7(15)11(13-9)12-8(16)4-6-10(14-12)18-2/h3-6,15-16H,1-2H3
InChIKeyHKXXSLSCUVIYBH-UHFFFAOYSA-N
XLogP1.57
TPSA84.70 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.24
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(3-hydroxy-6-methoxy-2-pyridinyl)-6-methoxypyridin-3-ol?
The IUPAC name of 2-(3-hydroxy-6-methoxy-2-pyridinyl)-6-methoxypyridin-3-ol (CID 175477358) is 2-(3-hydroxy-6-methoxy-2-pyridinyl)-6-methoxypyridin-3-ol.
What is the SMILES notation for 2-(3-hydroxy-6-methoxy-2-pyridinyl)-6-methoxypyridin-3-ol?
The canonical SMILES for 2-(3-hydroxy-6-methoxy-2-pyridinyl)-6-methoxypyridin-3-ol is COc1ccc(O)c(-c2nc(OC)ccc2O)n1.
What is the InChIKey of 2-(3-hydroxy-6-methoxy-2-pyridinyl)-6-methoxypyridin-3-ol?
The InChIKey is HKXXSLSCUVIYBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O4/c1-17-9-5-3-7(15)11(13-9)12-8(16)4-6-10(14-12)18-2/h3-6,15-16H,1-2H3.
What are the key properties of 2-(3-hydroxy-6-methoxy-2-pyridinyl)-6-methoxypyridin-3-ol?
2-(3-hydroxy-6-methoxy-2-pyridinyl)-6-methoxypyridin-3-ol has a molecular weight of 248.24 g/mol, XLogP of 1.57, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-hydroxy-6-methoxy-2-pyridinyl)-6-methoxypyridin-3-ol is sourced from PubChem (CID 175477358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).