2-(2-hydroxy-3-phenyldiazenylindol-1-yl)-N-(4-methylphenyl)acetamide

C23H20N4O2 — CID 3101781

IUPAC2-(2-hydroxy-3-phenyldiazenylindol-1-yl)-N-(4-methylphenyl)acetamide
SMILESCc1ccc(NC(=O)Cn2c(O)c(/N=N/c3ccccc3)c3ccccc32)cc1
InChIInChI=1S/C23H20N4O2/c1-16-11-13-17(14-12-16)24-21(28)15-27-20-10-6-5-9-19(20)22(23(27)29)26-25-18-7-3-2-4-8-18/h2-14,29H,15H2,1H3,(H,24,28)/b26-25+
InChIKeyJIXWGLBXKYHCCY-OCEACIFDSA-N
MW384.44 g/mol
LogP5.71
Rot. Bonds5

About 2-(2-hydroxy-3-phenyldiazenylindol-1-yl)-N-(4-methylphenyl)acetamide

2-(2-hydroxy-3-phenyldiazenylindol-1-yl)-N-(4-methylphenyl)acetamide (PubChem CID 3101781) has the molecular formula C23H20N4O2 and a molecular weight of 384.44 g/mol. Its IUPAC name is 2-(2-hydroxy-3-phenyldiazenylindol-1-yl)-N-(4-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(2-hydroxy-3-phenyldiazenylindol-1-yl)-N-(4-methylphenyl)acetamide
PubChem CID3101781
Molecular FormulaC23H20N4O2
Molecular Weight384.44 g/mol
Exact Mass384.16
IUPAC Name2-(2-hydroxy-3-phenyldiazenylindol-1-yl)-N-(4-methylphenyl)acetamide
SMILESCc1ccc(NC(=O)Cn2c(O)c(/N=N/c3ccccc3)c3ccccc32)cc1
InChIInChI=1S/C23H20N4O2/c1-16-11-13-17(14-12-16)24-21(28)15-27-20-10-6-5-9-19(20)22(23(27)29)26-25-18-7-3-2-4-8-18/h2-14,29H,15H2,1H3,(H,24,28)/b26-25+
InChIKeyJIXWGLBXKYHCCY-OCEACIFDSA-N
XLogP5.71
TPSA78.98 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500384.44
LogP ≤ 55.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-[2-hydroxy-1-[2-(4-methylanilino)-2-oxoethyl]indol-3-yl]imino-4-nitrobenzamide
CID 1048808
N'-[1-(2-anilino-2-oxoethyl)-5-bromo-2-hydroxyindol-3-yl]imino-N-(4-methylphenyl)oxamide
CID 4652493
2-[3-(carbamimidoyldiazenyl)-2-hydroxyindol-1-yl]-N-phenylacetamide
CID 2304852
2-[2-hydroxy-3-(2-hydroxyethyldiazenyl)indol-1-yl]-N-(3-methylphenyl)acetamide
CID 2333388
N-benzyl-N'-[2-hydroxy-1-[2-(3-methylanilino)-2-oxoethyl]indol-3-yl]iminooxamide
CID 3570088
N-(4-methylphenyl)-2-[3-(4-methylphenyl)-2,4-dioxoquinazolin-1-yl]acetamide
CID 22429419
N'-(2-hydroxy-1-pentylindol-3-yl)imino-N-(4-methylphenyl)oxamide
CID 135574739
2-[3-[(2-anilinoacetyl)diazenyl]-2-hydroxyindol-1-yl]acetic acid
CID 1255359
N-(4-methylphenyl)-2-(2-oxo-4-phenylquinazolin-1-yl)acetamide
CID 8721687
N-[1-[2-(2,4-dimethylanilino)-2-oxoethyl]-2-hydroxyindol-3-yl]imino-2-hydroxybenzamide
CID 4264369
3-[(4-methylphenyl)diazenyl]-1-(morpholin-4-ylmethyl)indol-2-ol
CID 4311773
4-[[2-hydroxy-1-(2-methylpropyl)indol-3-yl]diazenyl]benzoic acid
CID 135692431

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxy-3-phenyldiazenylindol-1-yl)-N-(4-methylphenyl)acetamide?
The IUPAC name of 2-(2-hydroxy-3-phenyldiazenylindol-1-yl)-N-(4-methylphenyl)acetamide (CID 3101781) is 2-(2-hydroxy-3-phenyldiazenylindol-1-yl)-N-(4-methylphenyl)acetamide.
What is the SMILES notation for 2-(2-hydroxy-3-phenyldiazenylindol-1-yl)-N-(4-methylphenyl)acetamide?
The canonical SMILES for 2-(2-hydroxy-3-phenyldiazenylindol-1-yl)-N-(4-methylphenyl)acetamide is Cc1ccc(NC(=O)Cn2c(O)c(/N=N/c3ccccc3)c3ccccc32)cc1.
What is the InChIKey of 2-(2-hydroxy-3-phenyldiazenylindol-1-yl)-N-(4-methylphenyl)acetamide?
The InChIKey is JIXWGLBXKYHCCY-OCEACIFDSA-N. The full InChI is InChI=1S/C23H20N4O2/c1-16-11-13-17(14-12-16)24-21(28)15-27-20-10-6-5-9-19(20)22(23(27)29)26-25-18-7-3-2-4-8-18/h2-14,29H,15H2,1H3,(H,24,28)/b26-25+.
What are the key properties of 2-(2-hydroxy-3-phenyldiazenylindol-1-yl)-N-(4-methylphenyl)acetamide?
2-(2-hydroxy-3-phenyldiazenylindol-1-yl)-N-(4-methylphenyl)acetamide has a molecular weight of 384.44 g/mol, XLogP of 5.71, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxy-3-phenyldiazenylindol-1-yl)-N-(4-methylphenyl)acetamide is sourced from PubChem (CID 3101781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).