5-amino-2-(4-aminophenyl)phenol

C12H12N2O — CID 14324230

IUPAC5-amino-2-(4-aminophenyl)phenol
SMILESNc1ccc(-c2ccc(N)cc2O)cc1
InChIInChI=1S/C12H12N2O/c13-9-3-1-8(2-4-9)11-6-5-10(14)7-12(11)15/h1-7,15H,13-14H2
InChIKeyKSCIRMBQFIRPIO-UHFFFAOYSA-N
MW200.24 g/mol
LogP2.22
Rot. Bonds1

About 5-amino-2-(4-aminophenyl)phenol

5-amino-2-(4-aminophenyl)phenol (PubChem CID 14324230) has the molecular formula C12H12N2O and a molecular weight of 200.24 g/mol. Its IUPAC name is 5-amino-2-(4-aminophenyl)phenol.

Molecular Properties

Compound Name5-amino-2-(4-aminophenyl)phenol
PubChem CID14324230
Molecular FormulaC12H12N2O
Molecular Weight200.24 g/mol
Exact Mass200.09
IUPAC Name5-amino-2-(4-aminophenyl)phenol
SMILESNc1ccc(-c2ccc(N)cc2O)cc1
InChIInChI=1S/C12H12N2O/c13-9-3-1-8(2-4-9)11-6-5-10(14)7-12(11)15/h1-7,15H,13-14H2
InChIKeyKSCIRMBQFIRPIO-UHFFFAOYSA-N
XLogP2.22
TPSA72.27 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.24
LogP ≤ 52.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 5-amino-2-(4-aminophenyl)phenol 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 5-amino-2-(4-aminophenyl)phenol?
The IUPAC name of 5-amino-2-(4-aminophenyl)phenol (CID 14324230) is 5-amino-2-(4-aminophenyl)phenol.
What is the SMILES notation for 5-amino-2-(4-aminophenyl)phenol?
The canonical SMILES for 5-amino-2-(4-aminophenyl)phenol is Nc1ccc(-c2ccc(N)cc2O)cc1.
What is the InChIKey of 5-amino-2-(4-aminophenyl)phenol?
The InChIKey is KSCIRMBQFIRPIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O/c13-9-3-1-8(2-4-9)11-6-5-10(14)7-12(11)15/h1-7,15H,13-14H2.
What are the key properties of 5-amino-2-(4-aminophenyl)phenol?
5-amino-2-(4-aminophenyl)phenol has a molecular weight of 200.24 g/mol, XLogP of 2.22, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-(4-aminophenyl)phenol is sourced from PubChem (CID 14324230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).