2-[3-hydroxy-3-(4-methylphenyl)-2-oxoindol-1-yl]-N-(2-methoxyphenyl)acetamide

C24H22N2O4 — CID 53144122

IUPAC2-[3-hydroxy-3-(4-methylphenyl)-2-oxoindol-1-yl]-N-(2-methoxyphenyl)acetamide
SMILESCOc1ccccc1NC(=O)CN1C(=O)C(O)(c2ccc(C)cc2)c2ccccc21
InChIInChI=1S/C24H22N2O4/c1-16-11-13-17(14-12-16)24(29)18-7-3-5-9-20(18)26(23(24)28)15-22(27)25-19-8-4-6-10-21(19)30-2/h3-14,29H,15H2,1-2H3,(H,25,27)
InChIKeyIBKCZEOBTOBZGT-UHFFFAOYSA-N
MW402.45 g/mol
LogP3.22
Rot. Bonds5

About 2-[3-hydroxy-3-(4-methylphenyl)-2-oxoindol-1-yl]-N-(2-methoxyphenyl)acetamide

2-[3-hydroxy-3-(4-methylphenyl)-2-oxoindol-1-yl]-N-(2-methoxyphenyl)acetamide (PubChem CID 53144122) has the molecular formula C24H22N2O4 and a molecular weight of 402.45 g/mol. Its IUPAC name is 2-[3-hydroxy-3-(4-methylphenyl)-2-oxoindol-1-yl]-N-(2-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-[3-hydroxy-3-(4-methylphenyl)-2-oxoindol-1-yl]-N-(2-methoxyphenyl)acetamide
PubChem CID53144122
Molecular FormulaC24H22N2O4
Molecular Weight402.45 g/mol
Exact Mass402.16
IUPAC Name2-[3-hydroxy-3-(4-methylphenyl)-2-oxoindol-1-yl]-N-(2-methoxyphenyl)acetamide
SMILESCOc1ccccc1NC(=O)CN1C(=O)C(O)(c2ccc(C)cc2)c2ccccc21
InChIInChI=1S/C24H22N2O4/c1-16-11-13-17(14-12-16)24(29)18-7-3-5-9-20(18)26(23(24)28)15-22(27)25-19-8-4-6-10-21(19)30-2/h3-14,29H,15H2,1-2H3,(H,25,27)
InChIKeyIBKCZEOBTOBZGT-UHFFFAOYSA-N
XLogP3.22
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.45
LogP ≤ 53.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 2-[[2-[3-hydroxy-3-(4-methylphenyl)-2-oxoindol-1-yl]acetyl]amino]benzoate
CID 53144125
N-(2-fluorophenyl)-2-[3-hydroxy-3-(4-methylphenyl)-2-oxoindol-1-yl]acetamide
CID 53144139
N-(2,3-dimethylphenyl)-2-[(3R)-3-hydroxy-3-(4-methylphenyl)-2-oxoindol-1-yl]acetamide
CID 95095250
2-[(3R)-3-hydroxy-3-(4-methylphenyl)-2-oxoindol-1-yl]-N-(4-methylphenyl)acetamide
CID 95095302
N-(2,4-dimethoxyphenyl)-2-[(3R)-3-hydroxy-2-oxo-3-phenylindol-1-yl]acetamide
CID 95095528
N-(2-methoxyphenyl)-2-[(4R)-4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetamide
CID 2582081
N-(2,4-dimethylphenyl)-2-[(3S)-3-hydroxy-2-oxo-3-phenylindol-1-yl]acetamide
CID 95095499
N-(3,4-dimethoxyphenyl)-2-[(3S)-3-hydroxy-3-(3-methylphenyl)-2-oxoindol-1-yl]acetamide
CID 95095174
2-[(3R)-3-hydroxy-2-oxo-3-phenylindol-1-yl]-N-(3-methoxyphenyl)acetamide
CID 95095552
N-(2-chloro-4-methylphenyl)-2-[(3S)-3-hydroxy-3-(3-methylphenyl)-2-oxoindol-1-yl]acetamide
CID 95095195
2-[3-hydroxy-3-(3-methylphenyl)-2-oxoindol-1-yl]-N-(4-methoxyphenyl)acetamide
CID 53144104
2-[(3S)-3-(3-chlorophenyl)-3-hydroxy-2-oxoindol-1-yl]-N-(2,4-dimethylphenyl)acetamide
CID 95095431

Frequently Asked Questions

What is the IUPAC name of 2-[3-hydroxy-3-(4-methylphenyl)-2-oxoindol-1-yl]-N-(2-methoxyphenyl)acetamide?
The IUPAC name of 2-[3-hydroxy-3-(4-methylphenyl)-2-oxoindol-1-yl]-N-(2-methoxyphenyl)acetamide (CID 53144122) is 2-[3-hydroxy-3-(4-methylphenyl)-2-oxoindol-1-yl]-N-(2-methoxyphenyl)acetamide.
What is the SMILES notation for 2-[3-hydroxy-3-(4-methylphenyl)-2-oxoindol-1-yl]-N-(2-methoxyphenyl)acetamide?
The canonical SMILES for 2-[3-hydroxy-3-(4-methylphenyl)-2-oxoindol-1-yl]-N-(2-methoxyphenyl)acetamide is COc1ccccc1NC(=O)CN1C(=O)C(O)(c2ccc(C)cc2)c2ccccc21.
What is the InChIKey of 2-[3-hydroxy-3-(4-methylphenyl)-2-oxoindol-1-yl]-N-(2-methoxyphenyl)acetamide?
The InChIKey is IBKCZEOBTOBZGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N2O4/c1-16-11-13-17(14-12-16)24(29)18-7-3-5-9-20(18)26(23(24)28)15-22(27)25-19-8-4-6-10-21(19)30-2/h3-14,29H,15H2,1-2H3,(H,25,27).
What are the key properties of 2-[3-hydroxy-3-(4-methylphenyl)-2-oxoindol-1-yl]-N-(2-methoxyphenyl)acetamide?
2-[3-hydroxy-3-(4-methylphenyl)-2-oxoindol-1-yl]-N-(2-methoxyphenyl)acetamide has a molecular weight of 402.45 g/mol, XLogP of 3.22, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-hydroxy-3-(4-methylphenyl)-2-oxoindol-1-yl]-N-(2-methoxyphenyl)acetamide is sourced from PubChem (CID 53144122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).