[5-(4-aminophenyl)furan-2-yl]methanol

C11H11NO2 — CID 745887

IUPAC[5-(4-aminophenyl)furan-2-yl]methanol
SMILESNc1ccc(-c2ccc(CO)o2)cc1
InChIInChI=1S/C11H11NO2/c12-9-3-1-8(2-4-9)11-6-5-10(7-13)14-11/h1-6,13H,7,12H2
InChIKeyPGRYIWSQXZECGD-UHFFFAOYSA-N
MW189.21 g/mol
LogP2.02
Rot. Bonds2

About [5-(4-aminophenyl)furan-2-yl]methanol

[5-(4-aminophenyl)furan-2-yl]methanol (PubChem CID 745887) has the molecular formula C11H11NO2 and a molecular weight of 189.21 g/mol. Its IUPAC name is [5-(4-aminophenyl)furan-2-yl]methanol.

Molecular Properties

Compound Name[5-(4-aminophenyl)furan-2-yl]methanol
PubChem CID745887
Molecular FormulaC11H11NO2
Molecular Weight189.21 g/mol
Exact Mass189.08
IUPAC Name[5-(4-aminophenyl)furan-2-yl]methanol
SMILESNc1ccc(-c2ccc(CO)o2)cc1
InChIInChI=1S/C11H11NO2/c12-9-3-1-8(2-4-9)11-6-5-10(7-13)14-11/h1-6,13H,7,12H2
InChIKeyPGRYIWSQXZECGD-UHFFFAOYSA-N
XLogP2.02
TPSA59.39 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.21
LogP ≤ 52.02
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 [5-(4-aminophenyl)furan-2-yl]methanol?
The IUPAC name of [5-(4-aminophenyl)furan-2-yl]methanol (CID 745887) is [5-(4-aminophenyl)furan-2-yl]methanol.
What is the SMILES notation for [5-(4-aminophenyl)furan-2-yl]methanol?
The canonical SMILES for [5-(4-aminophenyl)furan-2-yl]methanol is Nc1ccc(-c2ccc(CO)o2)cc1.
What is the InChIKey of [5-(4-aminophenyl)furan-2-yl]methanol?
The InChIKey is PGRYIWSQXZECGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO2/c12-9-3-1-8(2-4-9)11-6-5-10(7-13)14-11/h1-6,13H,7,12H2.
What are the key properties of [5-(4-aminophenyl)furan-2-yl]methanol?
[5-(4-aminophenyl)furan-2-yl]methanol has a molecular weight of 189.21 g/mol, XLogP of 2.02, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(4-aminophenyl)furan-2-yl]methanol is sourced from PubChem (CID 745887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).