3-aminonaphthalen-1-ol

C10H9NO — CID 23423083

IUPAC3-aminonaphthalen-1-ol
SMILESNc1cc(O)c2ccccc2c1
InChIInChI=1S/C10H9NO/c11-8-5-7-3-1-2-4-9(7)10(12)6-8/h1-6,12H,11H2
InChIKeyQMIJLOSXZVDDAT-UHFFFAOYSA-N
MW159.19 g/mol
LogP2.13
Rot. Bonds

About 3-aminonaphthalen-1-ol

3-aminonaphthalen-1-ol (PubChem CID 23423083) has the molecular formula C10H9NO and a molecular weight of 159.19 g/mol. Its IUPAC name is 3-aminonaphthalen-1-ol.

Molecular Properties

Compound Name3-aminonaphthalen-1-ol
PubChem CID23423083
Molecular FormulaC10H9NO
Molecular Weight159.19 g/mol
Exact Mass159.07
IUPAC Name3-aminonaphthalen-1-ol
SMILESNc1cc(O)c2ccccc2c1
InChIInChI=1S/C10H9NO/c11-8-5-7-3-1-2-4-9(7)10(12)6-8/h1-6,12H,11H2
InChIKeyQMIJLOSXZVDDAT-UHFFFAOYSA-N
XLogP2.13
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.19
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 3-aminonaphthalen-1-ol 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 3-aminonaphthalen-1-ol?
The IUPAC name of 3-aminonaphthalen-1-ol (CID 23423083) is 3-aminonaphthalen-1-ol.
What is the SMILES notation for 3-aminonaphthalen-1-ol?
The canonical SMILES for 3-aminonaphthalen-1-ol is Nc1cc(O)c2ccccc2c1.
What is the InChIKey of 3-aminonaphthalen-1-ol?
The InChIKey is QMIJLOSXZVDDAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9NO/c11-8-5-7-3-1-2-4-9(7)10(12)6-8/h1-6,12H,11H2.
What are the key properties of 3-aminonaphthalen-1-ol?
3-aminonaphthalen-1-ol has a molecular weight of 159.19 g/mol, XLogP of 2.13, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-aminonaphthalen-1-ol is sourced from PubChem (CID 23423083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).