2-(2,4-dimethoxyphenyl)-5-hydroxyimidazo[4,5-c]pyridine

C14H13N3O3 — CID 13175388

IUPAC2-(2,4-dimethoxyphenyl)-5-hydroxyimidazo[4,5-c]pyridine
SMILESCOc1ccc(-c2nc3ccn(O)cc-3n2)c(OC)c1
InChIInChI=1S/C14H13N3O3/c1-19-9-3-4-10(13(7-9)20-2)14-15-11-5-6-17(18)8-12(11)16-14/h3-8,18H,1-2H3
InChIKeyFJIFVTFFEGVIHK-UHFFFAOYSA-N
MW271.28 g/mol
LogP2.30
Rot. Bonds3

About 2-(2,4-dimethoxyphenyl)-5-hydroxyimidazo[4,5-c]pyridine

2-(2,4-dimethoxyphenyl)-5-hydroxyimidazo[4,5-c]pyridine (PubChem CID 13175388) has the molecular formula C14H13N3O3 and a molecular weight of 271.28 g/mol. Its IUPAC name is 2-(2,4-dimethoxyphenyl)-5-hydroxyimidazo[4,5-c]pyridine.

Molecular Properties

Compound Name2-(2,4-dimethoxyphenyl)-5-hydroxyimidazo[4,5-c]pyridine
PubChem CID13175388
Molecular FormulaC14H13N3O3
Molecular Weight271.28 g/mol
Exact Mass271.10
IUPAC Name2-(2,4-dimethoxyphenyl)-5-hydroxyimidazo[4,5-c]pyridine
SMILESCOc1ccc(-c2nc3ccn(O)cc-3n2)c(OC)c1
InChIInChI=1S/C14H13N3O3/c1-19-9-3-4-10(13(7-9)20-2)14-15-11-5-6-17(18)8-12(11)16-14/h3-8,18H,1-2H3
InChIKeyFJIFVTFFEGVIHK-UHFFFAOYSA-N
XLogP2.30
TPSA69.40 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.28
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-hydroxyl_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethoxyphenyl)-5-hydroxyimidazo[4,5-c]pyridine?
The IUPAC name of 2-(2,4-dimethoxyphenyl)-5-hydroxyimidazo[4,5-c]pyridine (CID 13175388) is 2-(2,4-dimethoxyphenyl)-5-hydroxyimidazo[4,5-c]pyridine.
What is the SMILES notation for 2-(2,4-dimethoxyphenyl)-5-hydroxyimidazo[4,5-c]pyridine?
The canonical SMILES for 2-(2,4-dimethoxyphenyl)-5-hydroxyimidazo[4,5-c]pyridine is COc1ccc(-c2nc3ccn(O)cc-3n2)c(OC)c1.
What is the InChIKey of 2-(2,4-dimethoxyphenyl)-5-hydroxyimidazo[4,5-c]pyridine?
The InChIKey is FJIFVTFFEGVIHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3O3/c1-19-9-3-4-10(13(7-9)20-2)14-15-11-5-6-17(18)8-12(11)16-14/h3-8,18H,1-2H3.
What are the key properties of 2-(2,4-dimethoxyphenyl)-5-hydroxyimidazo[4,5-c]pyridine?
2-(2,4-dimethoxyphenyl)-5-hydroxyimidazo[4,5-c]pyridine has a molecular weight of 271.28 g/mol, XLogP of 2.30, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethoxyphenyl)-5-hydroxyimidazo[4,5-c]pyridine is sourced from PubChem (CID 13175388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).