1-[(4-indol-1-ylphenyl)diazenyl]naphthalen-2-amine

C24H18N4 — CID 123928182

IUPAC1-[(4-indol-1-ylphenyl)diazenyl]naphthalen-2-amine
SMILESNc1ccc2ccccc2c1/N=N/c1ccc(-n2ccc3ccccc32)cc1
InChIInChI=1S/C24H18N4/c25-22-14-9-17-5-1-3-7-21(17)24(22)27-26-19-10-12-20(13-11-19)28-16-15-18-6-2-4-8-23(18)28/h1-16H,25H2/b27-26+
InChIKeyRYWVNLLEDMUDES-CYYJNZCTSA-N
MW362.44 g/mol
LogP6.78
Rot. Bonds3

About 1-[(4-indol-1-ylphenyl)diazenyl]naphthalen-2-amine

1-[(4-indol-1-ylphenyl)diazenyl]naphthalen-2-amine (PubChem CID 123928182) has the molecular formula C24H18N4 and a molecular weight of 362.44 g/mol. Its IUPAC name is 1-[(4-indol-1-ylphenyl)diazenyl]naphthalen-2-amine.

Molecular Properties

Compound Name1-[(4-indol-1-ylphenyl)diazenyl]naphthalen-2-amine
PubChem CID123928182
Molecular FormulaC24H18N4
Molecular Weight362.44 g/mol
Exact Mass362.15
IUPAC Name1-[(4-indol-1-ylphenyl)diazenyl]naphthalen-2-amine
SMILESNc1ccc2ccccc2c1/N=N/c1ccc(-n2ccc3ccccc32)cc1
InChIInChI=1S/C24H18N4/c25-22-14-9-17-5-1-3-7-21(17)24(22)27-26-19-10-12-20(13-11-19)28-16-15-18-6-2-4-8-23(18)28/h1-16H,25H2/b27-26+
InChIKeyRYWVNLLEDMUDES-CYYJNZCTSA-N
XLogP6.78
TPSA55.67 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500362.44
LogP ≤ 56.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

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Related Compounds

1-[4-(chloromethyl)phenyl]indole
CID 13021305
1-[[25-[(2-aminonaphthalen-1-yl)diazenyl]-2,5,8,15,18,21-hexaoxatricyclo[20.4.0.09,14]hexacosa-1(22),9(14),10,12,23,25-hexaen-11-yl]diazenyl]naphthalen-2-amine
CID 102505998
4-indol-1-ylbenzamide
CID 10879114
7-[(2-aminonaphthalen-1-yl)diazenyl]-N-(methylideneamino)dibenzofuran-3-amine
CID 134332917
phenyl-(1-phenyldiazenylnaphthalen-2-yl)diazene
CID 22616925
di(phenanthren-3-yl)diazene
CID 10786148
13-(3-indol-1-ylphenyl)-2-azapentacyclo[12.8.0.03,12.04,9.017,22]docosa-1,3(12),4,6,8,10,13,15,17,19,21-undecaene
CID 151443133
diphenyldiazene;naphthalen-1-amine
CID 159387194
1-(6-bromodibenzofuran-2-yl)indole
CID 121360385
9-phenanthren-2-yl-1-phenylpyrrolo[2,3-b]carbazole
CID 118315026
2-[(2-aminonaphthalen-1-yl)diazenyl]-5-methylphenol
CID 154145650
phenanthrene;sulfane
CID 159172584

Frequently Asked Questions

What is the IUPAC name of 1-[(4-indol-1-ylphenyl)diazenyl]naphthalen-2-amine?
The IUPAC name of 1-[(4-indol-1-ylphenyl)diazenyl]naphthalen-2-amine (CID 123928182) is 1-[(4-indol-1-ylphenyl)diazenyl]naphthalen-2-amine.
What is the SMILES notation for 1-[(4-indol-1-ylphenyl)diazenyl]naphthalen-2-amine?
The canonical SMILES for 1-[(4-indol-1-ylphenyl)diazenyl]naphthalen-2-amine is Nc1ccc2ccccc2c1/N=N/c1ccc(-n2ccc3ccccc32)cc1.
What is the InChIKey of 1-[(4-indol-1-ylphenyl)diazenyl]naphthalen-2-amine?
The InChIKey is RYWVNLLEDMUDES-CYYJNZCTSA-N. The full InChI is InChI=1S/C24H18N4/c25-22-14-9-17-5-1-3-7-21(17)24(22)27-26-19-10-12-20(13-11-19)28-16-15-18-6-2-4-8-23(18)28/h1-16H,25H2/b27-26+.
What are the key properties of 1-[(4-indol-1-ylphenyl)diazenyl]naphthalen-2-amine?
1-[(4-indol-1-ylphenyl)diazenyl]naphthalen-2-amine has a molecular weight of 362.44 g/mol, XLogP of 6.78, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-indol-1-ylphenyl)diazenyl]naphthalen-2-amine is sourced from PubChem (CID 123928182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).