5-amino-2-(3-methoxyphenyl)phenol

C13H13NO2 — CID 12067776

IUPAC5-amino-2-(3-methoxyphenyl)phenol
SMILESCOc1cccc(-c2ccc(N)cc2O)c1
InChIInChI=1S/C13H13NO2/c1-16-11-4-2-3-9(7-11)12-6-5-10(14)8-13(12)15/h2-8,15H,14H2,1H3
InChIKeyYNXKPMMOFDTCRF-UHFFFAOYSA-N
MW215.25 g/mol
LogP2.65
Rot. Bonds2

About 5-amino-2-(3-methoxyphenyl)phenol

5-amino-2-(3-methoxyphenyl)phenol (PubChem CID 12067776) has the molecular formula C13H13NO2 and a molecular weight of 215.25 g/mol. Its IUPAC name is 5-amino-2-(3-methoxyphenyl)phenol.

Molecular Properties

Compound Name5-amino-2-(3-methoxyphenyl)phenol
PubChem CID12067776
Molecular FormulaC13H13NO2
Molecular Weight215.25 g/mol
Exact Mass215.09
IUPAC Name5-amino-2-(3-methoxyphenyl)phenol
SMILESCOc1cccc(-c2ccc(N)cc2O)c1
InChIInChI=1S/C13H13NO2/c1-16-11-4-2-3-9(7-11)12-6-5-10(14)8-13(12)15/h2-8,15H,14H2,1H3
InChIKeyYNXKPMMOFDTCRF-UHFFFAOYSA-N
XLogP2.65
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.25
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 5-amino-2-(3-methoxyphenyl)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-(3-methoxyphenyl)phenol?
The IUPAC name of 5-amino-2-(3-methoxyphenyl)phenol (CID 12067776) is 5-amino-2-(3-methoxyphenyl)phenol.
What is the SMILES notation for 5-amino-2-(3-methoxyphenyl)phenol?
The canonical SMILES for 5-amino-2-(3-methoxyphenyl)phenol is COc1cccc(-c2ccc(N)cc2O)c1.
What is the InChIKey of 5-amino-2-(3-methoxyphenyl)phenol?
The InChIKey is YNXKPMMOFDTCRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13NO2/c1-16-11-4-2-3-9(7-11)12-6-5-10(14)8-13(12)15/h2-8,15H,14H2,1H3.
What are the key properties of 5-amino-2-(3-methoxyphenyl)phenol?
5-amino-2-(3-methoxyphenyl)phenol has a molecular weight of 215.25 g/mol, XLogP of 2.65, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-(3-methoxyphenyl)phenol is sourced from PubChem (CID 12067776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).