2-(2,3-dioxoindol-1-yl)-N-(4-hydroxyphenyl)acetamide

C16H12N2O4 — CID 3329233

IUPAC2-(2,3-dioxoindol-1-yl)-N-(4-hydroxyphenyl)acetamide
SMILESO=C(CN1C(=O)C(=O)c2ccccc21)Nc1ccc(O)cc1
InChIInChI=1S/C16H12N2O4/c19-11-7-5-10(6-8-11)17-14(20)9-18-13-4-2-1-3-12(13)15(21)16(18)22/h1-8,19H,9H2,(H,17,20)
InChIKeyAKBZVUUQHVAIOA-UHFFFAOYSA-N
MW296.28 g/mol
LogP1.56
Rot. Bonds3

About 2-(2,3-dioxoindol-1-yl)-N-(4-hydroxyphenyl)acetamide

2-(2,3-dioxoindol-1-yl)-N-(4-hydroxyphenyl)acetamide (PubChem CID 3329233) has the molecular formula C16H12N2O4 and a molecular weight of 296.28 g/mol. Its IUPAC name is 2-(2,3-dioxoindol-1-yl)-N-(4-hydroxyphenyl)acetamide.

Molecular Properties

Compound Name2-(2,3-dioxoindol-1-yl)-N-(4-hydroxyphenyl)acetamide
PubChem CID3329233
Molecular FormulaC16H12N2O4
Molecular Weight296.28 g/mol
Exact Mass296.08
IUPAC Name2-(2,3-dioxoindol-1-yl)-N-(4-hydroxyphenyl)acetamide
SMILESO=C(CN1C(=O)C(=O)c2ccccc21)Nc1ccc(O)cc1
InChIInChI=1S/C16H12N2O4/c19-11-7-5-10(6-8-11)17-14(20)9-18-13-4-2-1-3-12(13)15(21)16(18)22/h1-8,19H,9H2,(H,17,20)
InChIKeyAKBZVUUQHVAIOA-UHFFFAOYSA-N
XLogP1.56
TPSA86.71 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.28
LogP ≤ 51.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

(E)-3-(4-hydroxybenzylidene)indolin-2-one
CID 10561847
2-(1,3-Dioxo-1,3-dihydro-isoindol-2-yl)-N-(3-hydroxy-phenyl)-acetamide
CID 741524
1-[(3-Hydroxyphenyl)methyl]-2,3-dioxo-indoline-5-carboxamide
CID 515970
1-[(3,5-Dihydroxyphenyl)methyl]-2,3-dioxo-indoline-5-carboxamide
CID 515971
N-[(1E,3E)-1-(4-Hydroxy-phenylcarbamoyl)-4-phenyl-buta-1,3-dienyl]-benzamide
CID 5913663
3-(4-Hydroxybenzylidenyl)indolin-2-one
CID 5874584
2-[4-(4-Fluoro-benzyl)-piperidine-1-carbonyl]-6-hydroxy-1H-quinolin-4-one
CID 11509163
6-hydroxy-2-[4-(4-methyl-benzyl)-piperidine-1-carbonyl]-1H-quinolin-4-one
CID 11538083
2-(4-Benzyl-piperidine-1-carbonyl)-6-hydroxy-1H-quinolin-4-one
CID 11653435
Scp-1
CID 667575
2-[[2-[4-(4-hydroxyphenyl)piperazin-1-yl]acetyl]amino]-N-(2-phenylethyl)benzamide
CID 16326078
(2Z)-3-[2-(dimethylamino)ethyl]-5-[(4-hydroxyphenyl)methylidene]-2-(2-oxo-1H-indol-3-ylidene)-1,3-thiazolidin-4-one
CID 57391989

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dioxoindol-1-yl)-N-(4-hydroxyphenyl)acetamide?
The IUPAC name of 2-(2,3-dioxoindol-1-yl)-N-(4-hydroxyphenyl)acetamide (CID 3329233) is 2-(2,3-dioxoindol-1-yl)-N-(4-hydroxyphenyl)acetamide.
What is the SMILES notation for 2-(2,3-dioxoindol-1-yl)-N-(4-hydroxyphenyl)acetamide?
The canonical SMILES for 2-(2,3-dioxoindol-1-yl)-N-(4-hydroxyphenyl)acetamide is O=C(CN1C(=O)C(=O)c2ccccc21)Nc1ccc(O)cc1.
What is the InChIKey of 2-(2,3-dioxoindol-1-yl)-N-(4-hydroxyphenyl)acetamide?
The InChIKey is AKBZVUUQHVAIOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N2O4/c19-11-7-5-10(6-8-11)17-14(20)9-18-13-4-2-1-3-12(13)15(21)16(18)22/h1-8,19H,9H2,(H,17,20).
What are the key properties of 2-(2,3-dioxoindol-1-yl)-N-(4-hydroxyphenyl)acetamide?
2-(2,3-dioxoindol-1-yl)-N-(4-hydroxyphenyl)acetamide has a molecular weight of 296.28 g/mol, XLogP of 1.56, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dioxoindol-1-yl)-N-(4-hydroxyphenyl)acetamide is sourced from PubChem (CID 3329233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).