N-(1-methyl-2,3-dihydroindol-6-yl)-3-(2-oxopyrrolidin-1-yl)benzamide

C20H21N3O2 — CID 155946788

IUPACN-(1-methyl-2,3-dihydroindol-6-yl)-3-(2-oxopyrrolidin-1-yl)benzamide
SMILESCN1CCc2ccc(NC(=O)c3cccc(N4CCCC4=O)c3)cc21
InChIInChI=1S/C20H21N3O2/c1-22-11-9-14-7-8-16(13-18(14)22)21-20(25)15-4-2-5-17(12-15)23-10-3-6-19(23)24/h2,4-5,7-8,12-13H,3,6,9-11H2,1H3,(H,21,25)
InChIKeyNBIMABKFLOYAEO-UHFFFAOYSA-N
MW335.41 g/mol
LogP3.06
Rot. Bonds3

About N-(1-methyl-2,3-dihydroindol-6-yl)-3-(2-oxopyrrolidin-1-yl)benzamide

N-(1-methyl-2,3-dihydroindol-6-yl)-3-(2-oxopyrrolidin-1-yl)benzamide (PubChem CID 155946788) has the molecular formula C20H21N3O2 and a molecular weight of 335.41 g/mol. Its IUPAC name is N-(1-methyl-2,3-dihydroindol-6-yl)-3-(2-oxopyrrolidin-1-yl)benzamide.

Molecular Properties

Compound NameN-(1-methyl-2,3-dihydroindol-6-yl)-3-(2-oxopyrrolidin-1-yl)benzamide
PubChem CID155946788
Molecular FormulaC20H21N3O2
Molecular Weight335.41 g/mol
Exact Mass335.16
IUPAC NameN-(1-methyl-2,3-dihydroindol-6-yl)-3-(2-oxopyrrolidin-1-yl)benzamide
SMILESCN1CCc2ccc(NC(=O)c3cccc(N4CCCC4=O)c3)cc21
InChIInChI=1S/C20H21N3O2/c1-22-11-9-14-7-8-16(13-18(14)22)21-20(25)15-4-2-5-17(12-15)23-10-3-6-19(23)24/h2,4-5,7-8,12-13H,3,6,9-11H2,1H3,(H,21,25)
InChIKeyNBIMABKFLOYAEO-UHFFFAOYSA-N
XLogP3.06
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.41
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-methyl-2,3-dihydroindol-6-yl)-3-(2-oxopyrrolidin-1-yl)benzamide?
The IUPAC name of N-(1-methyl-2,3-dihydroindol-6-yl)-3-(2-oxopyrrolidin-1-yl)benzamide (CID 155946788) is N-(1-methyl-2,3-dihydroindol-6-yl)-3-(2-oxopyrrolidin-1-yl)benzamide.
What is the SMILES notation for N-(1-methyl-2,3-dihydroindol-6-yl)-3-(2-oxopyrrolidin-1-yl)benzamide?
The canonical SMILES for N-(1-methyl-2,3-dihydroindol-6-yl)-3-(2-oxopyrrolidin-1-yl)benzamide is CN1CCc2ccc(NC(=O)c3cccc(N4CCCC4=O)c3)cc21.
What is the InChIKey of N-(1-methyl-2,3-dihydroindol-6-yl)-3-(2-oxopyrrolidin-1-yl)benzamide?
The InChIKey is NBIMABKFLOYAEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3O2/c1-22-11-9-14-7-8-16(13-18(14)22)21-20(25)15-4-2-5-17(12-15)23-10-3-6-19(23)24/h2,4-5,7-8,12-13H,3,6,9-11H2,1H3,(H,21,25).
What are the key properties of N-(1-methyl-2,3-dihydroindol-6-yl)-3-(2-oxopyrrolidin-1-yl)benzamide?
N-(1-methyl-2,3-dihydroindol-6-yl)-3-(2-oxopyrrolidin-1-yl)benzamide has a molecular weight of 335.41 g/mol, XLogP of 3.06, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methyl-2,3-dihydroindol-6-yl)-3-(2-oxopyrrolidin-1-yl)benzamide is sourced from PubChem (CID 155946788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).