2-[2-[2-[[3-(2-oxo-1,3-dihydroindol-5-yl)-2-pyridinyl]amino]ethoxy]phenyl]acetamide

C23H22N4O3 — CID 175788089

IUPAC2-[2-[2-[[3-(2-oxo-1,3-dihydroindol-5-yl)-2-pyridinyl]amino]ethoxy]phenyl]acetamide
SMILESNC(=O)Cc1ccccc1OCCNc1ncccc1-c1ccc2c(c1)CC(=O)N2
InChIInChI=1S/C23H22N4O3/c24-21(28)13-16-4-1-2-6-20(16)30-11-10-26-23-18(5-3-9-25-23)15-7-8-19-17(12-15)14-22(29)27-19/h1-9,12H,10-11,13-14H2,(H2,24,28)(H,25,26)(H,27,29)
InChIKeyJZFSLCFYGHFRKG-UHFFFAOYSA-N
MW402.45 g/mol
LogP2.76
Rot. Bonds8

About 2-[2-[2-[[3-(2-oxo-1,3-dihydroindol-5-yl)-2-pyridinyl]amino]ethoxy]phenyl]acetamide

2-[2-[2-[[3-(2-oxo-1,3-dihydroindol-5-yl)-2-pyridinyl]amino]ethoxy]phenyl]acetamide (PubChem CID 175788089) has the molecular formula C23H22N4O3 and a molecular weight of 402.45 g/mol. Its IUPAC name is 2-[2-[2-[[3-(2-oxo-1,3-dihydroindol-5-yl)-2-pyridinyl]amino]ethoxy]phenyl]acetamide.

Molecular Properties

Compound Name2-[2-[2-[[3-(2-oxo-1,3-dihydroindol-5-yl)-2-pyridinyl]amino]ethoxy]phenyl]acetamide
PubChem CID175788089
Molecular FormulaC23H22N4O3
Molecular Weight402.45 g/mol
Exact Mass402.17
IUPAC Name2-[2-[2-[[3-(2-oxo-1,3-dihydroindol-5-yl)-2-pyridinyl]amino]ethoxy]phenyl]acetamide
SMILESNC(=O)Cc1ccccc1OCCNc1ncccc1-c1ccc2c(c1)CC(=O)N2
InChIInChI=1S/C23H22N4O3/c24-21(28)13-16-4-1-2-6-20(16)30-11-10-26-23-18(5-3-9-25-23)15-7-8-19-17(12-15)14-22(29)27-19/h1-9,12H,10-11,13-14H2,(H2,24,28)(H,25,26)(H,27,29)
InChIKeyJZFSLCFYGHFRKG-UHFFFAOYSA-N
XLogP2.76
TPSA106.34 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms30
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.45
LogP ≤ 52.76
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 2-[2-[2-[[3-(2-oxo-1,3-dihydroindol-5-yl)-2-pyridinyl]amino]ethoxy]phenyl]acetamide 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-[2-[2-[[3-(2-oxo-1,3-dihydroindol-5-yl)-2-pyridinyl]amino]ethoxy]phenyl]acetamide?
The IUPAC name of 2-[2-[2-[[3-(2-oxo-1,3-dihydroindol-5-yl)-2-pyridinyl]amino]ethoxy]phenyl]acetamide (CID 175788089) is 2-[2-[2-[[3-(2-oxo-1,3-dihydroindol-5-yl)-2-pyridinyl]amino]ethoxy]phenyl]acetamide.
What is the SMILES notation for 2-[2-[2-[[3-(2-oxo-1,3-dihydroindol-5-yl)-2-pyridinyl]amino]ethoxy]phenyl]acetamide?
The canonical SMILES for 2-[2-[2-[[3-(2-oxo-1,3-dihydroindol-5-yl)-2-pyridinyl]amino]ethoxy]phenyl]acetamide is NC(=O)Cc1ccccc1OCCNc1ncccc1-c1ccc2c(c1)CC(=O)N2.
What is the InChIKey of 2-[2-[2-[[3-(2-oxo-1,3-dihydroindol-5-yl)-2-pyridinyl]amino]ethoxy]phenyl]acetamide?
The InChIKey is JZFSLCFYGHFRKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N4O3/c24-21(28)13-16-4-1-2-6-20(16)30-11-10-26-23-18(5-3-9-25-23)15-7-8-19-17(12-15)14-22(29)27-19/h1-9,12H,10-11,13-14H2,(H2,24,28)(H,25,26)(H,27,29).
What are the key properties of 2-[2-[2-[[3-(2-oxo-1,3-dihydroindol-5-yl)-2-pyridinyl]amino]ethoxy]phenyl]acetamide?
2-[2-[2-[[3-(2-oxo-1,3-dihydroindol-5-yl)-2-pyridinyl]amino]ethoxy]phenyl]acetamide has a molecular weight of 402.45 g/mol, XLogP of 2.76, 8 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-[[3-(2-oxo-1,3-dihydroindol-5-yl)-2-pyridinyl]amino]ethoxy]phenyl]acetamide is sourced from PubChem (CID 175788089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).