2-(4-aminophenyl)-1-benzofuran-5-ol

C14H11NO2 — CID 11499570

IUPAC2-(4-aminophenyl)-1-benzofuran-5-ol
SMILESNc1ccc(-c2cc3cc(O)ccc3o2)cc1
InChIInChI=1S/C14H11NO2/c15-11-3-1-9(2-4-11)14-8-10-7-12(16)5-6-13(10)17-14/h1-8,16H,15H2
InChIKeyJDGXRZSZWVUFMN-UHFFFAOYSA-N
MW225.25 g/mol
LogP3.39
Rot. Bonds1

About 2-(4-aminophenyl)-1-benzofuran-5-ol

2-(4-aminophenyl)-1-benzofuran-5-ol (PubChem CID 11499570) has the molecular formula C14H11NO2 and a molecular weight of 225.25 g/mol. Its IUPAC name is 2-(4-aminophenyl)-1-benzofuran-5-ol.

Molecular Properties

Compound Name2-(4-aminophenyl)-1-benzofuran-5-ol
PubChem CID11499570
Molecular FormulaC14H11NO2
Molecular Weight225.25 g/mol
Exact Mass225.08
IUPAC Name2-(4-aminophenyl)-1-benzofuran-5-ol
SMILESNc1ccc(-c2cc3cc(O)ccc3o2)cc1
InChIInChI=1S/C14H11NO2/c15-11-3-1-9(2-4-11)14-8-10-7-12(16)5-6-13(10)17-14/h1-8,16H,15H2
InChIKeyJDGXRZSZWVUFMN-UHFFFAOYSA-N
XLogP3.39
TPSA59.39 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 53.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(4-aminophenyl)-1-benzofuran-5-ol?
The IUPAC name of 2-(4-aminophenyl)-1-benzofuran-5-ol (CID 11499570) is 2-(4-aminophenyl)-1-benzofuran-5-ol.
What is the SMILES notation for 2-(4-aminophenyl)-1-benzofuran-5-ol?
The canonical SMILES for 2-(4-aminophenyl)-1-benzofuran-5-ol is Nc1ccc(-c2cc3cc(O)ccc3o2)cc1.
What is the InChIKey of 2-(4-aminophenyl)-1-benzofuran-5-ol?
The InChIKey is JDGXRZSZWVUFMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11NO2/c15-11-3-1-9(2-4-11)14-8-10-7-12(16)5-6-13(10)17-14/h1-8,16H,15H2.
What are the key properties of 2-(4-aminophenyl)-1-benzofuran-5-ol?
2-(4-aminophenyl)-1-benzofuran-5-ol has a molecular weight of 225.25 g/mol, XLogP of 3.39, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminophenyl)-1-benzofuran-5-ol is sourced from PubChem (CID 11499570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).