2-aminophenol

C6H7NO — CID 5801

IUPAC2-aminophenol
SMILESNc1ccccc1O
InChIInChI=1S/C6H7NO/c7-5-3-1-2-4-6(5)8/h1-4,8H,7H2
InChIKeyCDAWCLOXVUBKRW-UHFFFAOYSA-N
MW109.13 g/mol
LogP0.97
Rot. Bonds

About 2-aminophenol

2-aminophenol (PubChem CID 5801) has the molecular formula C6H7NO and a molecular weight of 109.13 g/mol. Its IUPAC name is 2-aminophenol.

Molecular Properties

Compound Name2-aminophenol
PubChem CID5801
Molecular FormulaC6H7NO
Molecular Weight109.13 g/mol
Exact Mass109.05
IUPAC Name2-aminophenol
SMILESNc1ccccc1O
InChIInChI=1S/C6H7NO/c7-5-3-1-2-4-6(5)8/h1-4,8H,7H2
InChIKeyCDAWCLOXVUBKRW-UHFFFAOYSA-N
XLogP0.97
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500109.13
LogP ≤ 50.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-aminophenol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-Aminophenol
CID 11568
4-Aminophenol
CID 403
2-Nitrophenol
CID 6947
2-Amino-4-chlorophenol
CID 7265
2,4-Diaminophenol hydrochloride
CID 8715
2-Amino-5-methylphenol
CID 76082
4-Aminophenol hydrochloride
CID 5828
2-Amino-4-methylphenol
CID 7264
2,4-Diaminophenol
CID 7266
2,2'-Azobisphenol
CID 74902
Oxophenarsine
CID 10845
Catecholamine
CID 189460

Frequently Asked Questions

What is the IUPAC name of 2-aminophenol?
The IUPAC name of 2-aminophenol (CID 5801) is 2-aminophenol.
What is the SMILES notation for 2-aminophenol?
The canonical SMILES for 2-aminophenol is Nc1ccccc1O.
What is the InChIKey of 2-aminophenol?
The InChIKey is CDAWCLOXVUBKRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7NO/c7-5-3-1-2-4-6(5)8/h1-4,8H,7H2.
What are the key properties of 2-aminophenol?
2-aminophenol has a molecular weight of 109.13 g/mol, XLogP of 0.97, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminophenol is sourced from PubChem (CID 5801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).