8-(4-phenylphenyl)naphthalen-1-amine

C22H17N — CID 141449237

IUPAC8-(4-phenylphenyl)naphthalen-1-amine
SMILESNc1cccc2cccc(-c3ccc(-c4ccccc4)cc3)c12
InChIInChI=1S/C22H17N/c23-21-11-5-9-19-8-4-10-20(22(19)21)18-14-12-17(13-15-18)16-6-2-1-3-7-16/h1-15H,23H2
InChIKeyVHUQESPZXYIGGB-UHFFFAOYSA-N
MW295.38 g/mol
LogP5.76
Rot. Bonds2

About 8-(4-phenylphenyl)naphthalen-1-amine

8-(4-phenylphenyl)naphthalen-1-amine (PubChem CID 141449237) has the molecular formula C22H17N and a molecular weight of 295.38 g/mol. Its IUPAC name is 8-(4-phenylphenyl)naphthalen-1-amine.

Molecular Properties

Compound Name8-(4-phenylphenyl)naphthalen-1-amine
PubChem CID141449237
Molecular FormulaC22H17N
Molecular Weight295.38 g/mol
Exact Mass295.14
IUPAC Name8-(4-phenylphenyl)naphthalen-1-amine
SMILESNc1cccc2cccc(-c3ccc(-c4ccccc4)cc3)c12
InChIInChI=1S/C22H17N/c23-21-11-5-9-19-8-4-10-20(22(19)21)18-14-12-17(13-15-18)16-6-2-1-3-7-16/h1-15H,23H2
InChIKeyVHUQESPZXYIGGB-UHFFFAOYSA-N
XLogP5.76
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500295.38
LogP ≤ 55.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 8-(4-phenylphenyl)naphthalen-1-amine 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 8-(4-phenylphenyl)naphthalen-1-amine?
The IUPAC name of 8-(4-phenylphenyl)naphthalen-1-amine (CID 141449237) is 8-(4-phenylphenyl)naphthalen-1-amine.
What is the SMILES notation for 8-(4-phenylphenyl)naphthalen-1-amine?
The canonical SMILES for 8-(4-phenylphenyl)naphthalen-1-amine is Nc1cccc2cccc(-c3ccc(-c4ccccc4)cc3)c12.
What is the InChIKey of 8-(4-phenylphenyl)naphthalen-1-amine?
The InChIKey is VHUQESPZXYIGGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17N/c23-21-11-5-9-19-8-4-10-20(22(19)21)18-14-12-17(13-15-18)16-6-2-1-3-7-16/h1-15H,23H2.
What are the key properties of 8-(4-phenylphenyl)naphthalen-1-amine?
8-(4-phenylphenyl)naphthalen-1-amine has a molecular weight of 295.38 g/mol, XLogP of 5.76, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(4-phenylphenyl)naphthalen-1-amine is sourced from PubChem (CID 141449237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).