3-(8-aminonaphthalen-1-yl)naphthalen-2-ol

C20H15NO — CID 86216943

IUPAC3-(8-aminonaphthalen-1-yl)naphthalen-2-ol
SMILESNc1cccc2cccc(-c3cc4ccccc4cc3O)c12
InChIInChI=1S/C20H15NO/c21-18-10-4-8-13-7-3-9-16(20(13)18)17-11-14-5-1-2-6-15(14)12-19(17)22/h1-12,22H,21H2
InChIKeyFODVRTKCKXXTTK-UHFFFAOYSA-N
MW285.35 g/mol
LogP4.95
Rot. Bonds1

About 3-(8-aminonaphthalen-1-yl)naphthalen-2-ol

3-(8-aminonaphthalen-1-yl)naphthalen-2-ol (PubChem CID 86216943) has the molecular formula C20H15NO and a molecular weight of 285.35 g/mol. Its IUPAC name is 3-(8-aminonaphthalen-1-yl)naphthalen-2-ol.

Molecular Properties

Compound Name3-(8-aminonaphthalen-1-yl)naphthalen-2-ol
PubChem CID86216943
Molecular FormulaC20H15NO
Molecular Weight285.35 g/mol
Exact Mass285.12
IUPAC Name3-(8-aminonaphthalen-1-yl)naphthalen-2-ol
SMILESNc1cccc2cccc(-c3cc4ccccc4cc3O)c12
InChIInChI=1S/C20H15NO/c21-18-10-4-8-13-7-3-9-16(20(13)18)17-11-14-5-1-2-6-15(14)12-19(17)22/h1-12,22H,21H2
InChIKeyFODVRTKCKXXTTK-UHFFFAOYSA-N
XLogP4.95
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 54.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-(8-aminonaphthalen-1-yl)naphthalen-2-ol?
The IUPAC name of 3-(8-aminonaphthalen-1-yl)naphthalen-2-ol (CID 86216943) is 3-(8-aminonaphthalen-1-yl)naphthalen-2-ol.
What is the SMILES notation for 3-(8-aminonaphthalen-1-yl)naphthalen-2-ol?
The canonical SMILES for 3-(8-aminonaphthalen-1-yl)naphthalen-2-ol is Nc1cccc2cccc(-c3cc4ccccc4cc3O)c12.
What is the InChIKey of 3-(8-aminonaphthalen-1-yl)naphthalen-2-ol?
The InChIKey is FODVRTKCKXXTTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15NO/c21-18-10-4-8-13-7-3-9-16(20(13)18)17-11-14-5-1-2-6-15(14)12-19(17)22/h1-12,22H,21H2.
What are the key properties of 3-(8-aminonaphthalen-1-yl)naphthalen-2-ol?
3-(8-aminonaphthalen-1-yl)naphthalen-2-ol has a molecular weight of 285.35 g/mol, XLogP of 4.95, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(8-aminonaphthalen-1-yl)naphthalen-2-ol is sourced from PubChem (CID 86216943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).