2-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-N-(1-phenylethyl)acetamide

C20H22N2O2 — CID 110770933

IUPAC2-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-N-(1-phenylethyl)acetamide
SMILESCC(NC(=O)Cc1ccc2c(c1)C(C)(C)C(=O)N2)c1ccccc1
InChIInChI=1S/C20H22N2O2/c1-13(15-7-5-4-6-8-15)21-18(23)12-14-9-10-17-16(11-14)20(2,3)19(24)22-17/h4-11,13H,12H2,1-3H3,(H,21,23)(H,22,24)
InChIKeyGGTKVHIPSPJTPA-UHFFFAOYSA-N
MW322.41 g/mol
LogP3.34
Rot. Bonds4

About 2-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-N-(1-phenylethyl)acetamide

2-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-N-(1-phenylethyl)acetamide (PubChem CID 110770933) has the molecular formula C20H22N2O2 and a molecular weight of 322.41 g/mol. Its IUPAC name is 2-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-N-(1-phenylethyl)acetamide.

Molecular Properties

Compound Name2-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-N-(1-phenylethyl)acetamide
PubChem CID110770933
Molecular FormulaC20H22N2O2
Molecular Weight322.41 g/mol
Exact Mass322.17
IUPAC Name2-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-N-(1-phenylethyl)acetamide
SMILESCC(NC(=O)Cc1ccc2c(c1)C(C)(C)C(=O)N2)c1ccccc1
InChIInChI=1S/C20H22N2O2/c1-13(15-7-5-4-6-8-15)21-18(23)12-14-9-10-17-16(11-14)20(2,3)19(24)22-17/h4-11,13H,12H2,1-3H3,(H,21,23)(H,22,24)
InChIKeyGGTKVHIPSPJTPA-UHFFFAOYSA-N
XLogP3.34
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.41
LogP ≤ 53.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-oxo-1,3-dihydroindol-5-yl)-N-(1-phenylethyl)acetamide
CID 110768091
2-(3,4-dihydroxyphenyl)-N-(1-phenylethyl)acetamide
CID 113199018
2-[4-(2-methylpropyl)phenyl]-N-(1-phenylethyl)acetamide
CID 86249193
2-[4-(aminomethyl)phenyl]-N-[(1R)-1-phenylethyl]acetamide
CID 107863936
2-(4-carbamothioylphenyl)-N-(1-phenylethyl)acetamide
CID 63589427
2-(4-nitrophenyl)-N-(1-phenylethyl)acetamide
CID 2726136
2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(1S)-1-phenylethyl]acetamide
CID 51606566
2-(3-fluoro-4-methoxyphenyl)-N-[(1R)-1-phenylethyl]acetamide
CID 9032944
N-[(1R)-1-phenylethyl]-2-sulfanylacetamide
CID 130013972
N-[1-(4-ethylphenyl)ethyl]-2-phenylacetamide
CID 2854113
N-[(1S)-1-(4-fluorophenyl)ethyl]-2-phenylacetamide
CID 2713141
2-(2,5-dimethylphenyl)-N-(1-phenylethyl)acetamide
CID 43905087

Frequently Asked Questions

What is the IUPAC name of 2-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-N-(1-phenylethyl)acetamide?
The IUPAC name of 2-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-N-(1-phenylethyl)acetamide (CID 110770933) is 2-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-N-(1-phenylethyl)acetamide.
What is the SMILES notation for 2-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-N-(1-phenylethyl)acetamide?
The canonical SMILES for 2-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-N-(1-phenylethyl)acetamide is CC(NC(=O)Cc1ccc2c(c1)C(C)(C)C(=O)N2)c1ccccc1.
What is the InChIKey of 2-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-N-(1-phenylethyl)acetamide?
The InChIKey is GGTKVHIPSPJTPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O2/c1-13(15-7-5-4-6-8-15)21-18(23)12-14-9-10-17-16(11-14)20(2,3)19(24)22-17/h4-11,13H,12H2,1-3H3,(H,21,23)(H,22,24).
What are the key properties of 2-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-N-(1-phenylethyl)acetamide?
2-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-N-(1-phenylethyl)acetamide has a molecular weight of 322.41 g/mol, XLogP of 3.34, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,3-dimethyl-2-oxo-1H-indol-5-yl)-N-(1-phenylethyl)acetamide is sourced from PubChem (CID 110770933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).