N-(4-bromophenyl)-2-[(3R)-3-hydroxy-2-oxo-3-phenylindol-1-yl]acetamide

C22H17BrN2O3 — CID 95095563

IUPACN-(4-bromophenyl)-2-[(3R)-3-hydroxy-2-oxo-3-phenylindol-1-yl]acetamide
SMILESO=C(CN1C(=O)[C@@](O)(c2ccccc2)c2ccccc21)Nc1ccc(Br)cc1
InChIInChI=1S/C22H17BrN2O3/c23-16-10-12-17(13-11-16)24-20(26)14-25-19-9-5-4-8-18(19)22(28,21(25)27)15-6-2-1-3-7-15/h1-13,28H,14H2,(H,24,26)/t22-/m1/s1
InChIKeyBMQCBAIQWUUVIJ-JOCHJYFZSA-N
MW437.29 g/mol
LogP3.67
Rot. Bonds4

About N-(4-bromophenyl)-2-[(3R)-3-hydroxy-2-oxo-3-phenylindol-1-yl]acetamide

N-(4-bromophenyl)-2-[(3R)-3-hydroxy-2-oxo-3-phenylindol-1-yl]acetamide (PubChem CID 95095563) has the molecular formula C22H17BrN2O3 and a molecular weight of 437.29 g/mol. Its IUPAC name is N-(4-bromophenyl)-2-[(3R)-3-hydroxy-2-oxo-3-phenylindol-1-yl]acetamide.

Molecular Properties

Compound NameN-(4-bromophenyl)-2-[(3R)-3-hydroxy-2-oxo-3-phenylindol-1-yl]acetamide
PubChem CID95095563
Molecular FormulaC22H17BrN2O3
Molecular Weight437.29 g/mol
Exact Mass436.04
IUPAC NameN-(4-bromophenyl)-2-[(3R)-3-hydroxy-2-oxo-3-phenylindol-1-yl]acetamide
SMILESO=C(CN1C(=O)[C@@](O)(c2ccccc2)c2ccccc21)Nc1ccc(Br)cc1
InChIInChI=1S/C22H17BrN2O3/c23-16-10-12-17(13-11-16)24-20(26)14-25-19-9-5-4-8-18(19)22(28,21(25)27)15-6-2-1-3-7-15/h1-13,28H,14H2,(H,24,26)/t22-/m1/s1
InChIKeyBMQCBAIQWUUVIJ-JOCHJYFZSA-N
XLogP3.67
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500437.29
LogP ≤ 53.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-ethylphenyl)-2-(3-hydroxy-2-oxo-3-phenylindol-1-yl)acetamide
CID 53144238
2-(3-hydroxy-2-oxo-3-phenylindol-1-yl)-N-(4-methoxyphenyl)acetamide
CID 53144266
2-[(3R)-3-hydroxy-3-(4-methylphenyl)-2-oxoindol-1-yl]-N-(4-methylphenyl)acetamide
CID 95095302
N-(3-chlorophenyl)-2-[(3S)-3-hydroxy-2-oxo-3-phenylindol-1-yl]acetamide
CID 95095558
N-(3-fluoro-4-methylphenyl)-2-[(3S)-3-hydroxy-2-oxo-3-phenylindol-1-yl]acetamide
CID 95095513
N-(3,5-dimethoxyphenyl)-2-(3-hydroxy-2-oxo-3-phenylindol-1-yl)acetamide
CID 53144251
2-[(3R)-3-hydroxy-2-oxo-3-phenylindol-1-yl]-N-(3-methoxyphenyl)acetamide
CID 95095552
N-(4-bromophenyl)-2-[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]acetamide
CID 2580352
2-[3-hydroxy-3-(3-methylphenyl)-2-oxoindol-1-yl]-N-(4-methoxyphenyl)acetamide
CID 53144104
N-(2,4-dimethylphenyl)-2-[(3S)-3-hydroxy-2-oxo-3-phenylindol-1-yl]acetamide
CID 95095499
N-(2-ethyl-6-methylphenyl)-2-(3-hydroxy-2-oxo-3-phenylindol-1-yl)acetamide
CID 53144270
2-[(3S)-3-(3-chlorophenyl)-3-hydroxy-2-oxoindol-1-yl]-N-(3-methylphenyl)acetamide
CID 95095451

Frequently Asked Questions

What is the IUPAC name of N-(4-bromophenyl)-2-[(3R)-3-hydroxy-2-oxo-3-phenylindol-1-yl]acetamide?
The IUPAC name of N-(4-bromophenyl)-2-[(3R)-3-hydroxy-2-oxo-3-phenylindol-1-yl]acetamide (CID 95095563) is N-(4-bromophenyl)-2-[(3R)-3-hydroxy-2-oxo-3-phenylindol-1-yl]acetamide.
What is the SMILES notation for N-(4-bromophenyl)-2-[(3R)-3-hydroxy-2-oxo-3-phenylindol-1-yl]acetamide?
The canonical SMILES for N-(4-bromophenyl)-2-[(3R)-3-hydroxy-2-oxo-3-phenylindol-1-yl]acetamide is O=C(CN1C(=O)[C@@](O)(c2ccccc2)c2ccccc21)Nc1ccc(Br)cc1.
What is the InChIKey of N-(4-bromophenyl)-2-[(3R)-3-hydroxy-2-oxo-3-phenylindol-1-yl]acetamide?
The InChIKey is BMQCBAIQWUUVIJ-JOCHJYFZSA-N. The full InChI is InChI=1S/C22H17BrN2O3/c23-16-10-12-17(13-11-16)24-20(26)14-25-19-9-5-4-8-18(19)22(28,21(25)27)15-6-2-1-3-7-15/h1-13,28H,14H2,(H,24,26)/t22-/m1/s1.
What are the key properties of N-(4-bromophenyl)-2-[(3R)-3-hydroxy-2-oxo-3-phenylindol-1-yl]acetamide?
N-(4-bromophenyl)-2-[(3R)-3-hydroxy-2-oxo-3-phenylindol-1-yl]acetamide has a molecular weight of 437.29 g/mol, XLogP of 3.67, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromophenyl)-2-[(3R)-3-hydroxy-2-oxo-3-phenylindol-1-yl]acetamide is sourced from PubChem (CID 95095563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).