2-(2,3-dioxoindol-1-yl)-N,N-diphenylacetamide

C22H16N2O3 — CID 4713777

IUPAC2-(2,3-dioxoindol-1-yl)-N,N-diphenylacetamide
SMILESO=C1C(=O)N(CC(=O)N(c2ccccc2)c2ccccc2)c2ccccc21
InChIInChI=1S/C22H16N2O3/c25-20(15-23-19-14-8-7-13-18(19)21(26)22(23)27)24(16-9-3-1-4-10-16)17-11-5-2-6-12-17/h1-14H,15H2
InChIKeyYLTQKGBCYOKERC-UHFFFAOYSA-N
MW356.38 g/mol
LogP3.58
Rot. Bonds4

About 2-(2,3-dioxoindol-1-yl)-N,N-diphenylacetamide

2-(2,3-dioxoindol-1-yl)-N,N-diphenylacetamide (PubChem CID 4713777) has the molecular formula C22H16N2O3 and a molecular weight of 356.38 g/mol. Its IUPAC name is 2-(2,3-dioxoindol-1-yl)-N,N-diphenylacetamide.

Molecular Properties

Compound Name2-(2,3-dioxoindol-1-yl)-N,N-diphenylacetamide
PubChem CID4713777
Molecular FormulaC22H16N2O3
Molecular Weight356.38 g/mol
Exact Mass356.12
IUPAC Name2-(2,3-dioxoindol-1-yl)-N,N-diphenylacetamide
SMILESO=C1C(=O)N(CC(=O)N(c2ccccc2)c2ccccc2)c2ccccc21
InChIInChI=1S/C22H16N2O3/c25-20(15-23-19-14-8-7-13-18(19)21(26)22(23)27)24(16-9-3-1-4-10-16)17-11-5-2-6-12-17/h1-14H,15H2
InChIKeyYLTQKGBCYOKERC-UHFFFAOYSA-N
XLogP3.58
TPSA57.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.38
LogP ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dioxoindol-1-yl)-N,N-diphenylacetamide?
The IUPAC name of 2-(2,3-dioxoindol-1-yl)-N,N-diphenylacetamide (CID 4713777) is 2-(2,3-dioxoindol-1-yl)-N,N-diphenylacetamide.
What is the SMILES notation for 2-(2,3-dioxoindol-1-yl)-N,N-diphenylacetamide?
The canonical SMILES for 2-(2,3-dioxoindol-1-yl)-N,N-diphenylacetamide is O=C1C(=O)N(CC(=O)N(c2ccccc2)c2ccccc2)c2ccccc21.
What is the InChIKey of 2-(2,3-dioxoindol-1-yl)-N,N-diphenylacetamide?
The InChIKey is YLTQKGBCYOKERC-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16N2O3/c25-20(15-23-19-14-8-7-13-18(19)21(26)22(23)27)24(16-9-3-1-4-10-16)17-11-5-2-6-12-17/h1-14H,15H2.
What are the key properties of 2-(2,3-dioxoindol-1-yl)-N,N-diphenylacetamide?
2-(2,3-dioxoindol-1-yl)-N,N-diphenylacetamide has a molecular weight of 356.38 g/mol, XLogP of 3.58, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dioxoindol-1-yl)-N,N-diphenylacetamide is sourced from PubChem (CID 4713777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).