2-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-(4-hydroxycyclohexyl)acetamide

C24H28N2O3 — CID 56861590

IUPAC2-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-(4-hydroxycyclohexyl)acetamide
SMILESCN1C(=O)C(CC(=O)NC2CCC(O)CC2)(Cc2ccccc2)c2ccccc21
InChIInChI=1S/C24H28N2O3/c1-26-21-10-6-5-9-20(21)24(23(26)29,15-17-7-3-2-4-8-17)16-22(28)25-18-11-13-19(27)14-12-18/h2-10,18-19,27H,11-16H2,1H3,(H,25,28)
InChIKeyAFTKFBYACWFVDN-UHFFFAOYSA-N
MW392.50 g/mol
LogP2.95
Rot. Bonds5

About 2-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-(4-hydroxycyclohexyl)acetamide

2-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-(4-hydroxycyclohexyl)acetamide (PubChem CID 56861590) has the molecular formula C24H28N2O3 and a molecular weight of 392.50 g/mol. Its IUPAC name is 2-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-(4-hydroxycyclohexyl)acetamide.

Molecular Properties

Compound Name2-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-(4-hydroxycyclohexyl)acetamide
PubChem CID56861590
Molecular FormulaC24H28N2O3
Molecular Weight392.50 g/mol
Exact Mass392.21
IUPAC Name2-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-(4-hydroxycyclohexyl)acetamide
SMILESCN1C(=O)C(CC(=O)NC2CCC(O)CC2)(Cc2ccccc2)c2ccccc21
InChIInChI=1S/C24H28N2O3/c1-26-21-10-6-5-9-20(21)24(23(26)29,15-17-7-3-2-4-8-17)16-22(28)25-18-11-13-19(27)14-12-18/h2-10,18-19,27H,11-16H2,1H3,(H,25,28)
InChIKeyAFTKFBYACWFVDN-UHFFFAOYSA-N
XLogP2.95
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.50
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-(4-hydroxycyclohexyl)acetamide?
The IUPAC name of 2-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-(4-hydroxycyclohexyl)acetamide (CID 56861590) is 2-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-(4-hydroxycyclohexyl)acetamide.
What is the SMILES notation for 2-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-(4-hydroxycyclohexyl)acetamide?
The canonical SMILES for 2-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-(4-hydroxycyclohexyl)acetamide is CN1C(=O)C(CC(=O)NC2CCC(O)CC2)(Cc2ccccc2)c2ccccc21.
What is the InChIKey of 2-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-(4-hydroxycyclohexyl)acetamide?
The InChIKey is AFTKFBYACWFVDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N2O3/c1-26-21-10-6-5-9-20(21)24(23(26)29,15-17-7-3-2-4-8-17)16-22(28)25-18-11-13-19(27)14-12-18/h2-10,18-19,27H,11-16H2,1H3,(H,25,28).
What are the key properties of 2-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-(4-hydroxycyclohexyl)acetamide?
2-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-(4-hydroxycyclohexyl)acetamide has a molecular weight of 392.50 g/mol, XLogP of 2.95, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-benzyl-1-methyl-2-oxoindol-3-yl)-N-(4-hydroxycyclohexyl)acetamide is sourced from PubChem (CID 56861590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).