2-(3-acetylindol-1-yl)-N-(2-chlorophenyl)acetamide

C18H15ClN2O2 — CID 1088602

IUPAC2-(3-acetylindol-1-yl)-N-(2-chlorophenyl)acetamide
SMILESCC(=O)c1cn(CC(=O)Nc2ccccc2Cl)c2ccccc12
InChIInChI=1S/C18H15ClN2O2/c1-12(22)14-10-21(17-9-5-2-6-13(14)17)11-18(23)20-16-8-4-3-7-15(16)19/h2-10H,11H2,1H3,(H,20,23)
InChIKeyZLVQKDTWVSNOON-UHFFFAOYSA-N
MW326.78 g/mol
LogP4.14
Rot. Bonds4

About 2-(3-acetylindol-1-yl)-N-(2-chlorophenyl)acetamide

2-(3-acetylindol-1-yl)-N-(2-chlorophenyl)acetamide (PubChem CID 1088602) has the molecular formula C18H15ClN2O2 and a molecular weight of 326.78 g/mol. Its IUPAC name is 2-(3-acetylindol-1-yl)-N-(2-chlorophenyl)acetamide.

Molecular Properties

Compound Name2-(3-acetylindol-1-yl)-N-(2-chlorophenyl)acetamide
PubChem CID1088602
Molecular FormulaC18H15ClN2O2
Molecular Weight326.78 g/mol
Exact Mass326.08
IUPAC Name2-(3-acetylindol-1-yl)-N-(2-chlorophenyl)acetamide
SMILESCC(=O)c1cn(CC(=O)Nc2ccccc2Cl)c2ccccc12
InChIInChI=1S/C18H15ClN2O2/c1-12(22)14-10-21(17-9-5-2-6-13(14)17)11-18(23)20-16-8-4-3-7-15(16)19/h2-10H,11H2,1H3,(H,20,23)
InChIKeyZLVQKDTWVSNOON-UHFFFAOYSA-N
XLogP4.14
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.78
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3-acetylindol-1-yl)-N-(2-chlorophenyl)acetamide?
The IUPAC name of 2-(3-acetylindol-1-yl)-N-(2-chlorophenyl)acetamide (CID 1088602) is 2-(3-acetylindol-1-yl)-N-(2-chlorophenyl)acetamide.
What is the SMILES notation for 2-(3-acetylindol-1-yl)-N-(2-chlorophenyl)acetamide?
The canonical SMILES for 2-(3-acetylindol-1-yl)-N-(2-chlorophenyl)acetamide is CC(=O)c1cn(CC(=O)Nc2ccccc2Cl)c2ccccc12.
What is the InChIKey of 2-(3-acetylindol-1-yl)-N-(2-chlorophenyl)acetamide?
The InChIKey is ZLVQKDTWVSNOON-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15ClN2O2/c1-12(22)14-10-21(17-9-5-2-6-13(14)17)11-18(23)20-16-8-4-3-7-15(16)19/h2-10H,11H2,1H3,(H,20,23).
What are the key properties of 2-(3-acetylindol-1-yl)-N-(2-chlorophenyl)acetamide?
2-(3-acetylindol-1-yl)-N-(2-chlorophenyl)acetamide has a molecular weight of 326.78 g/mol, XLogP of 4.14, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-acetylindol-1-yl)-N-(2-chlorophenyl)acetamide is sourced from PubChem (CID 1088602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).