N-(4-acetamidophenyl)-3-(2,3-dihydroindole-1-carbonyl)benzamide

C24H21N3O3 — CID 109057111

IUPACN-(4-acetamidophenyl)-3-(2,3-dihydroindole-1-carbonyl)benzamide
SMILESCC(=O)Nc1ccc(NC(=O)c2cccc(C(=O)N3CCc4ccccc43)c2)cc1
InChIInChI=1S/C24H21N3O3/c1-16(28)25-20-9-11-21(12-10-20)26-23(29)18-6-4-7-19(15-18)24(30)27-14-13-17-5-2-3-8-22(17)27/h2-12,15H,13-14H2,1H3,(H,25,28)(H,26,29)
InChIKeyOHQJTRBJSNJPKW-UHFFFAOYSA-N
MW399.45 g/mol
LogP4.10
Rot. Bonds4

About N-(4-acetamidophenyl)-3-(2,3-dihydroindole-1-carbonyl)benzamide

N-(4-acetamidophenyl)-3-(2,3-dihydroindole-1-carbonyl)benzamide (PubChem CID 109057111) has the molecular formula C24H21N3O3 and a molecular weight of 399.45 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-3-(2,3-dihydroindole-1-carbonyl)benzamide.

Molecular Properties

Compound NameN-(4-acetamidophenyl)-3-(2,3-dihydroindole-1-carbonyl)benzamide
PubChem CID109057111
Molecular FormulaC24H21N3O3
Molecular Weight399.45 g/mol
Exact Mass399.16
IUPAC NameN-(4-acetamidophenyl)-3-(2,3-dihydroindole-1-carbonyl)benzamide
SMILESCC(=O)Nc1ccc(NC(=O)c2cccc(C(=O)N3CCc4ccccc43)c2)cc1
InChIInChI=1S/C24H21N3O3/c1-16(28)25-20-9-11-21(12-10-20)26-23(29)18-6-4-7-19(15-18)24(30)27-14-13-17-5-2-3-8-22(17)27/h2-12,15H,13-14H2,1H3,(H,25,28)(H,26,29)
InChIKeyOHQJTRBJSNJPKW-UHFFFAOYSA-N
XLogP4.10
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.45
LogP ≤ 54.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-acetamidophenyl)-4-(2,3-dihydroindole-1-carbonyl)benzamide
CID 109049557
N-[3-(2,3-dihydroindole-1-carbonyl)phenyl]acetamide
CID 26290520
3-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-(4-methoxyphenyl)benzamide
CID 109057134
N-(3-chloro-2-methylphenyl)-3-(2,3-dihydroindole-1-carbonyl)benzamide
CID 109057097
3-(2,3-dihydroindole-1-carbonyl)benzoic acid
CID 43452867
3-amino-N-[4-(3,4-dihydro-2H-quinoline-1-carbonyl)phenyl]benzamide
CID 19607806
3-hydroxy-N-[4-(2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl)phenyl]benzamide
CID 19607809
4-(2,3-dihydroindole-1-carbonyl)-N-(4-fluorophenyl)benzamide
CID 109049539
N-(4-chlorophenyl)-5-(2,3-dihydroindole-1-carbonyl)pyridine-3-carboxamide
CID 109108143
N-tert-butyl-3-(3,4-dihydro-2H-quinoline-1-carbonyl)benzamide
CID 109055995
3-(2,3-dihydroindole-1-carbonyl)-N-(2-methoxy-5-methylphenyl)benzamide
CID 109057107
N-(3,4-difluorophenyl)-4-(2,3-dihydroindole-1-carbonyl)benzamide
CID 109049570

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-3-(2,3-dihydroindole-1-carbonyl)benzamide?
The IUPAC name of N-(4-acetamidophenyl)-3-(2,3-dihydroindole-1-carbonyl)benzamide (CID 109057111) is N-(4-acetamidophenyl)-3-(2,3-dihydroindole-1-carbonyl)benzamide.
What is the SMILES notation for N-(4-acetamidophenyl)-3-(2,3-dihydroindole-1-carbonyl)benzamide?
The canonical SMILES for N-(4-acetamidophenyl)-3-(2,3-dihydroindole-1-carbonyl)benzamide is CC(=O)Nc1ccc(NC(=O)c2cccc(C(=O)N3CCc4ccccc43)c2)cc1.
What is the InChIKey of N-(4-acetamidophenyl)-3-(2,3-dihydroindole-1-carbonyl)benzamide?
The InChIKey is OHQJTRBJSNJPKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21N3O3/c1-16(28)25-20-9-11-21(12-10-20)26-23(29)18-6-4-7-19(15-18)24(30)27-14-13-17-5-2-3-8-22(17)27/h2-12,15H,13-14H2,1H3,(H,25,28)(H,26,29).
What are the key properties of N-(4-acetamidophenyl)-3-(2,3-dihydroindole-1-carbonyl)benzamide?
N-(4-acetamidophenyl)-3-(2,3-dihydroindole-1-carbonyl)benzamide has a molecular weight of 399.45 g/mol, XLogP of 4.10, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamidophenyl)-3-(2,3-dihydroindole-1-carbonyl)benzamide is sourced from PubChem (CID 109057111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).