2-[2-[(3S)-3-methyl-2-oxo-1,3-dihydroindol-5-yl]-2-oxoethoxy]-N-phenylbenzamide

C24H20N2O4 — CID 9018566

IUPAC2-[2-[(3S)-3-methyl-2-oxo-1,3-dihydroindol-5-yl]-2-oxoethoxy]-N-phenylbenzamide
SMILESC[C@@H]1C(=O)Nc2ccc(C(=O)COc3ccccc3C(=O)Nc3ccccc3)cc21
InChIInChI=1S/C24H20N2O4/c1-15-19-13-16(11-12-20(19)26-23(15)28)21(27)14-30-22-10-6-5-9-18(22)24(29)25-17-7-3-2-4-8-17/h2-13,15H,14H2,1H3,(H,25,29)(H,26,28)/t15-/m0/s1
InChIKeyFYHQXISYTHIUQX-HNNXBMFYSA-N
MW400.43 g/mol
LogP4.26
Rot. Bonds6

About 2-[2-[(3S)-3-methyl-2-oxo-1,3-dihydroindol-5-yl]-2-oxoethoxy]-N-phenylbenzamide

2-[2-[(3S)-3-methyl-2-oxo-1,3-dihydroindol-5-yl]-2-oxoethoxy]-N-phenylbenzamide (PubChem CID 9018566) has the molecular formula C24H20N2O4 and a molecular weight of 400.43 g/mol. Its IUPAC name is 2-[2-[(3S)-3-methyl-2-oxo-1,3-dihydroindol-5-yl]-2-oxoethoxy]-N-phenylbenzamide.

Molecular Properties

Compound Name2-[2-[(3S)-3-methyl-2-oxo-1,3-dihydroindol-5-yl]-2-oxoethoxy]-N-phenylbenzamide
PubChem CID9018566
Molecular FormulaC24H20N2O4
Molecular Weight400.43 g/mol
Exact Mass400.14
IUPAC Name2-[2-[(3S)-3-methyl-2-oxo-1,3-dihydroindol-5-yl]-2-oxoethoxy]-N-phenylbenzamide
SMILESC[C@@H]1C(=O)Nc2ccc(C(=O)COc3ccccc3C(=O)Nc3ccccc3)cc21
InChIInChI=1S/C24H20N2O4/c1-15-19-13-16(11-12-20(19)26-23(15)28)21(27)14-30-22-10-6-5-9-18(22)24(29)25-17-7-3-2-4-8-17/h2-13,15H,14H2,1H3,(H,25,29)(H,26,28)/t15-/m0/s1
InChIKeyFYHQXISYTHIUQX-HNNXBMFYSA-N
XLogP4.26
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.43
LogP ≤ 54.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[2-[(3S)-3-methyl-2-oxo-1,3-dihydroindol-5-yl]-2-oxoethoxy]-N-phenylbenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(3-methyl-2-oxo-1,3-dihydroindol-5-yl)benzamide
CID 110405864
[2-[(3R)-3-methyl-2-oxo-1,3-dihydroindol-5-yl]-2-oxoethyl] 2-(2-tert-butylphenoxy)acetate
CID 8539890
(3R)-5-[2-(3,4-dichlorophenoxy)acetyl]-3-methyl-1,3-dihydroindol-2-one
CID 9196934
(3S)-5-(2-chloroacetyl)-3-methyl-1,3-dihydroindol-2-one
CID 7129467
2-[2-(1-methylpyrrol-2-yl)-2-oxoethoxy]-N-phenylbenzamide
CID 31393111
2-[2-(3,5-dimethylanilino)-2-oxoethoxy]-N-phenylbenzamide
CID 7980967
[2-[(3S)-3-methyl-2-oxo-1,3-dihydroindol-5-yl]-2-oxoethyl] adamantane-1-carboxylate
CID 9017892
N-(3-methyl-2-oxo-1,3-dihydroindol-5-yl)-4-phenoxybutanamide
CID 110405900
methyl 4-[[[2-[2-(phenylcarbamoyl)phenoxy]acetyl]amino]methyl]benzoate
CID 7919593
[2-[(3S)-3-methyl-2-oxo-1,3-dihydroindol-5-yl]-2-oxoethyl] 3-chloro-1-benzothiophene-2-carboxylate
CID 9291069
[2-[(3R)-3-methyl-2-oxo-1,3-dihydroindol-5-yl]-2-oxoethyl] 2-oxochromene-3-carboxylate
CID 9290380
N-(4-anilinophenyl)-2-(2-methylprop-2-enoxy)benzamide
CID 17130408

Frequently Asked Questions

What is the IUPAC name of 2-[2-[(3S)-3-methyl-2-oxo-1,3-dihydroindol-5-yl]-2-oxoethoxy]-N-phenylbenzamide?
The IUPAC name of 2-[2-[(3S)-3-methyl-2-oxo-1,3-dihydroindol-5-yl]-2-oxoethoxy]-N-phenylbenzamide (CID 9018566) is 2-[2-[(3S)-3-methyl-2-oxo-1,3-dihydroindol-5-yl]-2-oxoethoxy]-N-phenylbenzamide.
What is the SMILES notation for 2-[2-[(3S)-3-methyl-2-oxo-1,3-dihydroindol-5-yl]-2-oxoethoxy]-N-phenylbenzamide?
The canonical SMILES for 2-[2-[(3S)-3-methyl-2-oxo-1,3-dihydroindol-5-yl]-2-oxoethoxy]-N-phenylbenzamide is C[C@@H]1C(=O)Nc2ccc(C(=O)COc3ccccc3C(=O)Nc3ccccc3)cc21.
What is the InChIKey of 2-[2-[(3S)-3-methyl-2-oxo-1,3-dihydroindol-5-yl]-2-oxoethoxy]-N-phenylbenzamide?
The InChIKey is FYHQXISYTHIUQX-HNNXBMFYSA-N. The full InChI is InChI=1S/C24H20N2O4/c1-15-19-13-16(11-12-20(19)26-23(15)28)21(27)14-30-22-10-6-5-9-18(22)24(29)25-17-7-3-2-4-8-17/h2-13,15H,14H2,1H3,(H,25,29)(H,26,28)/t15-/m0/s1.
What are the key properties of 2-[2-[(3S)-3-methyl-2-oxo-1,3-dihydroindol-5-yl]-2-oxoethoxy]-N-phenylbenzamide?
2-[2-[(3S)-3-methyl-2-oxo-1,3-dihydroindol-5-yl]-2-oxoethoxy]-N-phenylbenzamide has a molecular weight of 400.43 g/mol, XLogP of 4.26, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(3S)-3-methyl-2-oxo-1,3-dihydroindol-5-yl]-2-oxoethoxy]-N-phenylbenzamide is sourced from PubChem (CID 9018566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).