2-(2,3-dioxoindol-1-yl)-N-phenyl-N-propan-2-ylacetamide

C19H18N2O3 — CID 2142149

IUPAC2-(2,3-dioxoindol-1-yl)-N-phenyl-N-propan-2-ylacetamide
SMILESCC(C)N(C(=O)CN1C(=O)C(=O)c2ccccc21)c1ccccc1
InChIInChI=1S/C19H18N2O3/c1-13(2)21(14-8-4-3-5-9-14)17(22)12-20-16-11-7-6-10-15(16)18(23)19(20)24/h3-11,13H,12H2,1-2H3
InChIKeyKHFMKZBEJXACFG-UHFFFAOYSA-N
MW322.36 g/mol
LogP2.66
Rot. Bonds4

About 2-(2,3-dioxoindol-1-yl)-N-phenyl-N-propan-2-ylacetamide

2-(2,3-dioxoindol-1-yl)-N-phenyl-N-propan-2-ylacetamide (PubChem CID 2142149) has the molecular formula C19H18N2O3 and a molecular weight of 322.36 g/mol. Its IUPAC name is 2-(2,3-dioxoindol-1-yl)-N-phenyl-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-(2,3-dioxoindol-1-yl)-N-phenyl-N-propan-2-ylacetamide
PubChem CID2142149
Molecular FormulaC19H18N2O3
Molecular Weight322.36 g/mol
Exact Mass322.13
IUPAC Name2-(2,3-dioxoindol-1-yl)-N-phenyl-N-propan-2-ylacetamide
SMILESCC(C)N(C(=O)CN1C(=O)C(=O)c2ccccc21)c1ccccc1
InChIInChI=1S/C19H18N2O3/c1-13(2)21(14-8-4-3-5-9-14)17(22)12-20-16-11-7-6-10-15(16)18(23)19(20)24/h3-11,13H,12H2,1-2H3
InChIKeyKHFMKZBEJXACFG-UHFFFAOYSA-N
XLogP2.66
TPSA57.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.36
LogP ≤ 52.66
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-phenyl-N-propan-2-ylacetamide?
The IUPAC name of 2-(2,3-dioxoindol-1-yl)-N-phenyl-N-propan-2-ylacetamide (CID 2142149) is 2-(2,3-dioxoindol-1-yl)-N-phenyl-N-propan-2-ylacetamide.
What is the SMILES notation for 2-(2,3-dioxoindol-1-yl)-N-phenyl-N-propan-2-ylacetamide?
The canonical SMILES for 2-(2,3-dioxoindol-1-yl)-N-phenyl-N-propan-2-ylacetamide is CC(C)N(C(=O)CN1C(=O)C(=O)c2ccccc21)c1ccccc1.
What is the InChIKey of 2-(2,3-dioxoindol-1-yl)-N-phenyl-N-propan-2-ylacetamide?
The InChIKey is KHFMKZBEJXACFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O3/c1-13(2)21(14-8-4-3-5-9-14)17(22)12-20-16-11-7-6-10-15(16)18(23)19(20)24/h3-11,13H,12H2,1-2H3.
What are the key properties of 2-(2,3-dioxoindol-1-yl)-N-phenyl-N-propan-2-ylacetamide?
2-(2,3-dioxoindol-1-yl)-N-phenyl-N-propan-2-ylacetamide has a molecular weight of 322.36 g/mol, XLogP of 2.66, 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-phenyl-N-propan-2-ylacetamide is sourced from PubChem (CID 2142149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).