3-(1H-indol-3-yl)-N-(2-phenoxyethyl)propanamide

C19H20N2O2 — CID 4879910

IUPAC3-(1H-indol-3-yl)-N-(2-phenoxyethyl)propanamide
SMILESO=C(CCc1c[nH]c2ccccc12)NCCOc1ccccc1
InChIInChI=1S/C19H20N2O2/c22-19(20-12-13-23-16-6-2-1-3-7-16)11-10-15-14-21-18-9-5-4-8-17(15)18/h1-9,14,21H,10-13H2,(H,20,22)
InChIKeyWPFPQOXOXXSJGC-UHFFFAOYSA-N
MW308.38 g/mol
LogP3.30
Rot. Bonds7

About 3-(1H-indol-3-yl)-N-(2-phenoxyethyl)propanamide

3-(1H-indol-3-yl)-N-(2-phenoxyethyl)propanamide (PubChem CID 4879910) has the molecular formula C19H20N2O2 and a molecular weight of 308.38 g/mol. Its IUPAC name is 3-(1H-indol-3-yl)-N-(2-phenoxyethyl)propanamide.

Molecular Properties

Compound Name3-(1H-indol-3-yl)-N-(2-phenoxyethyl)propanamide
PubChem CID4879910
Molecular FormulaC19H20N2O2
Molecular Weight308.38 g/mol
Exact Mass308.15
IUPAC Name3-(1H-indol-3-yl)-N-(2-phenoxyethyl)propanamide
SMILESO=C(CCc1c[nH]c2ccccc12)NCCOc1ccccc1
InChIInChI=1S/C19H20N2O2/c22-19(20-12-13-23-16-6-2-1-3-7-16)11-10-15-14-21-18-9-5-4-8-17(15)18/h1-9,14,21H,10-13H2,(H,20,22)
InChIKeyWPFPQOXOXXSJGC-UHFFFAOYSA-N
XLogP3.30
TPSA54.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 53.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[2-[2-(1H-indol-3-yl)ethylamino]-2-oxoethyl]-3-phenoxypropanamide
CID 112993925
3-(1H-indol-3-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 10664257
N-[2-(4-chlorophenoxy)ethyl]-4-(1H-indol-3-yl)butanamide
CID 588709
N-[2-(2-fluorophenoxy)ethyl]-3-(1H-indol-3-yl)propanamide
CID 18170635
N-(2-ethoxyethyl)-3-(1H-indol-3-yl)propanamide
CID 43591658
4-(1H-indol-3-yl)-N-[2-[3-(1H-indol-3-yl)propanoylamino]ethyl]butanamide
CID 42506947
[2-[2-(1H-indol-3-yl)ethylamino]-2-oxoethyl] 2-phenoxyacetate
CID 9018351
N-[2-(4-ethylphenoxy)ethyl]-2-(1H-indol-3-yl)acetamide
CID 113100092
3-(1H-indol-3-yl)-N-(2-sulfamoylethyl)propanamide
CID 43582891
N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-3-phenoxypropanamide
CID 110731483
N-(2-phenoxyethyl)-1H-indole-3-carboxamide
CID 17447492
N-(2-ethoxyethyl)-4-(1H-indol-3-yl)butanamide
CID 43591663

Frequently Asked Questions

What is the IUPAC name of 3-(1H-indol-3-yl)-N-(2-phenoxyethyl)propanamide?
The IUPAC name of 3-(1H-indol-3-yl)-N-(2-phenoxyethyl)propanamide (CID 4879910) is 3-(1H-indol-3-yl)-N-(2-phenoxyethyl)propanamide.
What is the SMILES notation for 3-(1H-indol-3-yl)-N-(2-phenoxyethyl)propanamide?
The canonical SMILES for 3-(1H-indol-3-yl)-N-(2-phenoxyethyl)propanamide is O=C(CCc1c[nH]c2ccccc12)NCCOc1ccccc1.
What is the InChIKey of 3-(1H-indol-3-yl)-N-(2-phenoxyethyl)propanamide?
The InChIKey is WPFPQOXOXXSJGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O2/c22-19(20-12-13-23-16-6-2-1-3-7-16)11-10-15-14-21-18-9-5-4-8-17(15)18/h1-9,14,21H,10-13H2,(H,20,22).
What are the key properties of 3-(1H-indol-3-yl)-N-(2-phenoxyethyl)propanamide?
3-(1H-indol-3-yl)-N-(2-phenoxyethyl)propanamide has a molecular weight of 308.38 g/mol, XLogP of 3.30, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1H-indol-3-yl)-N-(2-phenoxyethyl)propanamide is sourced from PubChem (CID 4879910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).