2-(1H-indol-3-yl)-N-(2-morpholin-4-ylethyl)-2-oxoacetamide

C16H19N3O3 — CID 3163724

IUPAC2-(1H-indol-3-yl)-N-(2-morpholin-4-ylethyl)-2-oxoacetamide
SMILESO=C(NCCN1CCOCC1)C(=O)c1c[nH]c2ccccc12
InChIInChI=1S/C16H19N3O3/c20-15(13-11-18-14-4-2-1-3-12(13)14)16(21)17-5-6-19-7-9-22-10-8-19/h1-4,11,18H,5-10H2,(H,17,21)
InChIKeyGUSVFDAJWCEEOF-UHFFFAOYSA-N
MW301.35 g/mol
LogP0.80
Rot. Bonds5

About 2-(1H-indol-3-yl)-N-(2-morpholin-4-ylethyl)-2-oxoacetamide

2-(1H-indol-3-yl)-N-(2-morpholin-4-ylethyl)-2-oxoacetamide (PubChem CID 3163724) has the molecular formula C16H19N3O3 and a molecular weight of 301.35 g/mol. Its IUPAC name is 2-(1H-indol-3-yl)-N-(2-morpholin-4-ylethyl)-2-oxoacetamide.

Molecular Properties

Compound Name2-(1H-indol-3-yl)-N-(2-morpholin-4-ylethyl)-2-oxoacetamide
PubChem CID3163724
Molecular FormulaC16H19N3O3
Molecular Weight301.35 g/mol
Exact Mass301.14
IUPAC Name2-(1H-indol-3-yl)-N-(2-morpholin-4-ylethyl)-2-oxoacetamide
SMILESO=C(NCCN1CCOCC1)C(=O)c1c[nH]c2ccccc12
InChIInChI=1S/C16H19N3O3/c20-15(13-11-18-14-4-2-1-3-12(13)14)16(21)17-5-6-19-7-9-22-10-8-19/h1-4,11,18H,5-10H2,(H,17,21)
InChIKeyGUSVFDAJWCEEOF-UHFFFAOYSA-N
XLogP0.80
TPSA74.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.35
LogP ≤ 50.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-(1H-indol-3-yl)-N-(2-morpholin-4-ylethyl)-2-oxoacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(1H-indol-3-yl)-N-(2-morpholin-4-ylethyl)-2-oxoacetamide?
The IUPAC name of 2-(1H-indol-3-yl)-N-(2-morpholin-4-ylethyl)-2-oxoacetamide (CID 3163724) is 2-(1H-indol-3-yl)-N-(2-morpholin-4-ylethyl)-2-oxoacetamide.
What is the SMILES notation for 2-(1H-indol-3-yl)-N-(2-morpholin-4-ylethyl)-2-oxoacetamide?
The canonical SMILES for 2-(1H-indol-3-yl)-N-(2-morpholin-4-ylethyl)-2-oxoacetamide is O=C(NCCN1CCOCC1)C(=O)c1c[nH]c2ccccc12.
What is the InChIKey of 2-(1H-indol-3-yl)-N-(2-morpholin-4-ylethyl)-2-oxoacetamide?
The InChIKey is GUSVFDAJWCEEOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O3/c20-15(13-11-18-14-4-2-1-3-12(13)14)16(21)17-5-6-19-7-9-22-10-8-19/h1-4,11,18H,5-10H2,(H,17,21).
What are the key properties of 2-(1H-indol-3-yl)-N-(2-morpholin-4-ylethyl)-2-oxoacetamide?
2-(1H-indol-3-yl)-N-(2-morpholin-4-ylethyl)-2-oxoacetamide has a molecular weight of 301.35 g/mol, XLogP of 0.80, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-indol-3-yl)-N-(2-morpholin-4-ylethyl)-2-oxoacetamide is sourced from PubChem (CID 3163724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).