4-aminonaphthalen-1-ol

C10H9NO — CID 17815

IUPAC4-aminonaphthalen-1-ol
SMILESNc1ccc(O)c2ccccc12
InChIInChI=1S/C10H9NO/c11-9-5-6-10(12)8-4-2-1-3-7(8)9/h1-6,12H,11H2
InChIKeyABJQKDJOYSQVFX-UHFFFAOYSA-N
MW159.19 g/mol
LogP2.13
Rot. Bonds

About 4-aminonaphthalen-1-ol

4-aminonaphthalen-1-ol (PubChem CID 17815) has the molecular formula C10H9NO and a molecular weight of 159.19 g/mol. Its IUPAC name is 4-aminonaphthalen-1-ol.

Molecular Properties

Compound Name4-aminonaphthalen-1-ol
PubChem CID17815
Molecular FormulaC10H9NO
Molecular Weight159.19 g/mol
Exact Mass159.07
IUPAC Name4-aminonaphthalen-1-ol
SMILESNc1ccc(O)c2ccccc12
InChIInChI=1S/C10H9NO/c11-9-5-6-10(12)8-4-2-1-3-7(8)9/h1-6,12H,11H2
InChIKeyABJQKDJOYSQVFX-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'}, {'alert_name': 'hydroquinone', 'substructure': 'N/A'}

Analyze 4-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

Related Compounds

4-Amino-m-cresol
CID 17819
8-Amino-2-naphthalenol
CID 8358
1-Naphthalenol, 4-[2-(4-nitrophenyl)diazenyl]-
CID 79174
7-Amino-2-naphthalenol
CID 66732
Vitamin K5
CID 6754
1-Naphthol, 4-nitroso-
CID 69064
5-Amino-2-naphthol
CID 6865
5-Amino-2-hydroxytoluene
CID 76081
4-Amino-1-naphthol hydrochloride
CID 2723858
7-Amino-1-naphthol
CID 40116
6-Aminonaphthol
CID 90295
1-Amino-2-naphthol
CID 14535

Frequently Asked Questions

What is the IUPAC name of 4-aminonaphthalen-1-ol?
The IUPAC name of 4-aminonaphthalen-1-ol (CID 17815) is 4-aminonaphthalen-1-ol.
What is the SMILES notation for 4-aminonaphthalen-1-ol?
The canonical SMILES for 4-aminonaphthalen-1-ol is Nc1ccc(O)c2ccccc12.
What is the InChIKey of 4-aminonaphthalen-1-ol?
The InChIKey is ABJQKDJOYSQVFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9NO/c11-9-5-6-10(12)8-4-2-1-3-7(8)9/h1-6,12H,11H2.
What are the key properties of 4-aminonaphthalen-1-ol?
4-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 4-aminonaphthalen-1-ol is sourced from PubChem (CID 17815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).