2-(3-benzoylindol-1-yl)-N-(4-bromophenyl)acetamide

C23H17BrN2O2 — CID 2953380

IUPAC2-(3-benzoylindol-1-yl)-N-(4-bromophenyl)acetamide
SMILESO=C(Cn1cc(C(=O)c2ccccc2)c2ccccc21)Nc1ccc(Br)cc1
InChIInChI=1S/C23H17BrN2O2/c24-17-10-12-18(13-11-17)25-22(27)15-26-14-20(19-8-4-5-9-21(19)26)23(28)16-6-2-1-3-7-16/h1-14H,15H2,(H,25,27)
InChIKeyJQYYLGOGKIZGLS-UHFFFAOYSA-N
MW433.31 g/mol
LogP5.27
Rot. Bonds5

About 2-(3-benzoylindol-1-yl)-N-(4-bromophenyl)acetamide

2-(3-benzoylindol-1-yl)-N-(4-bromophenyl)acetamide (PubChem CID 2953380) has the molecular formula C23H17BrN2O2 and a molecular weight of 433.31 g/mol. Its IUPAC name is 2-(3-benzoylindol-1-yl)-N-(4-bromophenyl)acetamide.

Molecular Properties

Compound Name2-(3-benzoylindol-1-yl)-N-(4-bromophenyl)acetamide
PubChem CID2953380
Molecular FormulaC23H17BrN2O2
Molecular Weight433.31 g/mol
Exact Mass432.05
IUPAC Name2-(3-benzoylindol-1-yl)-N-(4-bromophenyl)acetamide
SMILESO=C(Cn1cc(C(=O)c2ccccc2)c2ccccc21)Nc1ccc(Br)cc1
InChIInChI=1S/C23H17BrN2O2/c24-17-10-12-18(13-11-17)25-22(27)15-26-14-20(19-8-4-5-9-21(19)26)23(28)16-6-2-1-3-7-16/h1-14H,15H2,(H,25,27)
InChIKeyJQYYLGOGKIZGLS-UHFFFAOYSA-N
XLogP5.27
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500433.31
LogP ≤ 55.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(3-benzoylindol-1-yl)-N-(4-bromophenyl)acetamide 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

2-(3-benzoylindol-1-yl)-N-[3-(trifluoromethyl)phenyl]acetamide
CID 2974288
2-(3-benzoylindol-1-yl)-N-propan-2-ylacetamide
CID 972360
2-(3-benzoylindol-1-yl)-N-(2,3-dimethylphenyl)acetamide
CID 2953381
methyl 1-[2-oxo-2-[4-(phenylcarbamoylamino)anilino]ethyl]indole-3-carboxylate
CID 46553530
2-(3-benzoyl-6-ethoxy-4-oxoquinolin-1-yl)-N-(4-ethoxyphenyl)acetamide
CID 16825294
2-(3-benzoylindol-1-yl)-N-cyclohexylacetamide
CID 2202973
2-(3-benzoylindol-1-yl)-N-(furan-2-ylmethyl)acetamide
CID 1089001
N-(4-methylphenyl)-2-[3-(thiophene-2-carbonyl)indol-1-yl]acetamide
CID 5043393
2-(3-acetylindol-1-yl)-N-(4-methoxyphenyl)acetamide
CID 1088565
2-[1-[2-(4-chloroanilino)-2-oxoethyl]indol-3-yl]-2-oxoacetamide
CID 5302279
2-(5-bromo-3-formylindol-1-yl)-N-(4-bromophenyl)acetamide
CID 4253502
2-[3-(4-ethylbenzoyl)-4-oxoquinolin-1-yl]-N-(4-propan-2-ylphenyl)acetamide
CID 16825310

Frequently Asked Questions

What is the IUPAC name of 2-(3-benzoylindol-1-yl)-N-(4-bromophenyl)acetamide?
The IUPAC name of 2-(3-benzoylindol-1-yl)-N-(4-bromophenyl)acetamide (CID 2953380) is 2-(3-benzoylindol-1-yl)-N-(4-bromophenyl)acetamide.
What is the SMILES notation for 2-(3-benzoylindol-1-yl)-N-(4-bromophenyl)acetamide?
The canonical SMILES for 2-(3-benzoylindol-1-yl)-N-(4-bromophenyl)acetamide is O=C(Cn1cc(C(=O)c2ccccc2)c2ccccc21)Nc1ccc(Br)cc1.
What is the InChIKey of 2-(3-benzoylindol-1-yl)-N-(4-bromophenyl)acetamide?
The InChIKey is JQYYLGOGKIZGLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H17BrN2O2/c24-17-10-12-18(13-11-17)25-22(27)15-26-14-20(19-8-4-5-9-21(19)26)23(28)16-6-2-1-3-7-16/h1-14H,15H2,(H,25,27).
What are the key properties of 2-(3-benzoylindol-1-yl)-N-(4-bromophenyl)acetamide?
2-(3-benzoylindol-1-yl)-N-(4-bromophenyl)acetamide has a molecular weight of 433.31 g/mol, XLogP of 5.27, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-benzoylindol-1-yl)-N-(4-bromophenyl)acetamide is sourced from PubChem (CID 2953380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).