2-(1H-indol-3-yl)-N-(2-methoxyphenyl)-2-oxoacetamide

C17H14N2O3 — CID 3149446

IUPAC2-(1H-indol-3-yl)-N-(2-methoxyphenyl)-2-oxoacetamide
SMILESCOc1ccccc1NC(=O)C(=O)c1c[nH]c2ccccc12
InChIInChI=1S/C17H14N2O3/c1-22-15-9-5-4-8-14(15)19-17(21)16(20)12-10-18-13-7-3-2-6-11(12)13/h2-10,18H,1H3,(H,19,21)
InChIKeyZIECFLNIXQAWBH-UHFFFAOYSA-N
MW294.31 g/mol
LogP3.00
Rot. Bonds4

About 2-(1H-indol-3-yl)-N-(2-methoxyphenyl)-2-oxoacetamide

2-(1H-indol-3-yl)-N-(2-methoxyphenyl)-2-oxoacetamide (PubChem CID 3149446) has the molecular formula C17H14N2O3 and a molecular weight of 294.31 g/mol. Its IUPAC name is 2-(1H-indol-3-yl)-N-(2-methoxyphenyl)-2-oxoacetamide.

Molecular Properties

Compound Name2-(1H-indol-3-yl)-N-(2-methoxyphenyl)-2-oxoacetamide
PubChem CID3149446
Molecular FormulaC17H14N2O3
Molecular Weight294.31 g/mol
Exact Mass294.10
IUPAC Name2-(1H-indol-3-yl)-N-(2-methoxyphenyl)-2-oxoacetamide
SMILESCOc1ccccc1NC(=O)C(=O)c1c[nH]c2ccccc12
InChIInChI=1S/C17H14N2O3/c1-22-15-9-5-4-8-14(15)19-17(21)16(20)12-10-18-13-7-3-2-6-11(12)13/h2-10,18H,1H3,(H,19,21)
InChIKeyZIECFLNIXQAWBH-UHFFFAOYSA-N
XLogP3.00
TPSA71.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.31
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(1H-indol-3-yl)-N-(2-methoxyphenyl)-2-oxoacetamide?
The IUPAC name of 2-(1H-indol-3-yl)-N-(2-methoxyphenyl)-2-oxoacetamide (CID 3149446) is 2-(1H-indol-3-yl)-N-(2-methoxyphenyl)-2-oxoacetamide.
What is the SMILES notation for 2-(1H-indol-3-yl)-N-(2-methoxyphenyl)-2-oxoacetamide?
The canonical SMILES for 2-(1H-indol-3-yl)-N-(2-methoxyphenyl)-2-oxoacetamide is COc1ccccc1NC(=O)C(=O)c1c[nH]c2ccccc12.
What is the InChIKey of 2-(1H-indol-3-yl)-N-(2-methoxyphenyl)-2-oxoacetamide?
The InChIKey is ZIECFLNIXQAWBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2O3/c1-22-15-9-5-4-8-14(15)19-17(21)16(20)12-10-18-13-7-3-2-6-11(12)13/h2-10,18H,1H3,(H,19,21).
What are the key properties of 2-(1H-indol-3-yl)-N-(2-methoxyphenyl)-2-oxoacetamide?
2-(1H-indol-3-yl)-N-(2-methoxyphenyl)-2-oxoacetamide has a molecular weight of 294.31 g/mol, XLogP of 3.00, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-indol-3-yl)-N-(2-methoxyphenyl)-2-oxoacetamide is sourced from PubChem (CID 3149446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).