3-naphthalen-1-yl-2-nitroso-1-phenylindole

C24H16N2O — CID 151659862

IUPAC3-naphthalen-1-yl-2-nitroso-1-phenylindole
SMILESO=Nc1c(-c2cccc3ccccc23)c2ccccc2n1-c1ccccc1
InChIInChI=1S/C24H16N2O/c27-25-24-23(20-15-8-10-17-9-4-5-13-19(17)20)21-14-6-7-16-22(21)26(24)18-11-2-1-3-12-18/h1-16H
InChIKeyQWHLWTVBWAUMDD-UHFFFAOYSA-N
MW348.41 g/mol
LogP6.85
Rot. Bonds3

About 3-naphthalen-1-yl-2-nitroso-1-phenylindole

3-naphthalen-1-yl-2-nitroso-1-phenylindole (PubChem CID 151659862) has the molecular formula C24H16N2O and a molecular weight of 348.41 g/mol. Its IUPAC name is 3-naphthalen-1-yl-2-nitroso-1-phenylindole.

Molecular Properties

Compound Name3-naphthalen-1-yl-2-nitroso-1-phenylindole
PubChem CID151659862
Molecular FormulaC24H16N2O
Molecular Weight348.41 g/mol
Exact Mass348.13
IUPAC Name3-naphthalen-1-yl-2-nitroso-1-phenylindole
SMILESO=Nc1c(-c2cccc3ccccc23)c2ccccc2n1-c1ccccc1
InChIInChI=1S/C24H16N2O/c27-25-24-23(20-15-8-10-17-9-4-5-13-19(17)20)21-14-6-7-16-22(21)26(24)18-11-2-1-3-12-18/h1-16H
InChIKeyQWHLWTVBWAUMDD-UHFFFAOYSA-N
XLogP6.85
TPSA34.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500348.41
LogP ≤ 56.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 3-naphthalen-1-yl-2-nitroso-1-phenylindole 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-naphthalen-1-yl-2-nitroso-1-phenylindole?
The IUPAC name of 3-naphthalen-1-yl-2-nitroso-1-phenylindole (CID 151659862) is 3-naphthalen-1-yl-2-nitroso-1-phenylindole.
What is the SMILES notation for 3-naphthalen-1-yl-2-nitroso-1-phenylindole?
The canonical SMILES for 3-naphthalen-1-yl-2-nitroso-1-phenylindole is O=Nc1c(-c2cccc3ccccc23)c2ccccc2n1-c1ccccc1.
What is the InChIKey of 3-naphthalen-1-yl-2-nitroso-1-phenylindole?
The InChIKey is QWHLWTVBWAUMDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H16N2O/c27-25-24-23(20-15-8-10-17-9-4-5-13-19(17)20)21-14-6-7-16-22(21)26(24)18-11-2-1-3-12-18/h1-16H.
What are the key properties of 3-naphthalen-1-yl-2-nitroso-1-phenylindole?
3-naphthalen-1-yl-2-nitroso-1-phenylindole has a molecular weight of 348.41 g/mol, XLogP of 6.85, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-naphthalen-1-yl-2-nitroso-1-phenylindole is sourced from PubChem (CID 151659862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).