2-(3-ethoxyphenoxy)-N-[2-(1H-indol-3-yl)ethyl]acetamide

C20H22N2O3 — CID 112977733

IUPAC2-(3-ethoxyphenoxy)-N-[2-(1H-indol-3-yl)ethyl]acetamide
SMILESCCOc1cccc(OCC(=O)NCCc2c[nH]c3ccccc23)c1
InChIInChI=1S/C20H22N2O3/c1-2-24-16-6-5-7-17(12-16)25-14-20(23)21-11-10-15-13-22-19-9-4-3-8-18(15)19/h3-9,12-13,22H,2,10-11,14H2,1H3,(H,21,23)
InChIKeyKITGOVRBWMKCTR-UHFFFAOYSA-N
MW338.41 g/mol
LogP3.30
Rot. Bonds8

About 2-(3-ethoxyphenoxy)-N-[2-(1H-indol-3-yl)ethyl]acetamide

2-(3-ethoxyphenoxy)-N-[2-(1H-indol-3-yl)ethyl]acetamide (PubChem CID 112977733) has the molecular formula C20H22N2O3 and a molecular weight of 338.41 g/mol. Its IUPAC name is 2-(3-ethoxyphenoxy)-N-[2-(1H-indol-3-yl)ethyl]acetamide.

Molecular Properties

Compound Name2-(3-ethoxyphenoxy)-N-[2-(1H-indol-3-yl)ethyl]acetamide
PubChem CID112977733
Molecular FormulaC20H22N2O3
Molecular Weight338.41 g/mol
Exact Mass338.16
IUPAC Name2-(3-ethoxyphenoxy)-N-[2-(1H-indol-3-yl)ethyl]acetamide
SMILESCCOc1cccc(OCC(=O)NCCc2c[nH]c3ccccc23)c1
InChIInChI=1S/C20H22N2O3/c1-2-24-16-6-5-7-17(12-16)25-14-20(23)21-11-10-15-13-22-19-9-4-3-8-18(15)19/h3-9,12-13,22H,2,10-11,14H2,1H3,(H,21,23)
InChIKeyKITGOVRBWMKCTR-UHFFFAOYSA-N
XLogP3.30
TPSA63.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.41
LogP ≤ 53.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-ethylphenoxy)-N-[2-(1H-indol-3-yl)ethyl]acetamide
CID 26710642
3-(4-ethoxyanilino)-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 109027444
[2-[2-(1H-indol-3-yl)ethylamino]-2-oxoethyl] 2-phenoxyacetate
CID 9018351
tris(5-ethoxy-3-propyl-1H-indole);N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]propanamide;3-propyl-1H-indole;3-propyl-1H-indol-5-ol
CID 161141076
N-[2-(1H-indol-3-yl)ethyl]-2-quinolin-6-yloxyacetamide
CID 112978626
3-(2-amino-2-oxoethoxy)-N-[2-(1H-indol-3-yl)ethyl]benzamide
CID 35559463
2-(N-acetyl-4-ethoxyanilino)-N-[2-(1H-indol-3-yl)ethyl]acetamide
CID 113173902
N'-[2-(1H-indol-3-yl)ethyl]-N-[2-(3-methoxyphenyl)ethyl]propanediamide
CID 108948641
3,4,5-triethoxy-N-[2-(1H-indol-3-yl)ethyl]benzamide
CID 27645186
3,4-diethoxy-N-[2-(1H-indol-3-yl)ethyl]benzamide
CID 27645310
3-(1H-indol-3-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 10664257
[2-[2-(1H-indol-3-yl)ethylamino]-2-oxoethyl] (2S)-2-(3-methylphenoxy)propanoate
CID 8846694

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethoxyphenoxy)-N-[2-(1H-indol-3-yl)ethyl]acetamide?
The IUPAC name of 2-(3-ethoxyphenoxy)-N-[2-(1H-indol-3-yl)ethyl]acetamide (CID 112977733) is 2-(3-ethoxyphenoxy)-N-[2-(1H-indol-3-yl)ethyl]acetamide.
What is the SMILES notation for 2-(3-ethoxyphenoxy)-N-[2-(1H-indol-3-yl)ethyl]acetamide?
The canonical SMILES for 2-(3-ethoxyphenoxy)-N-[2-(1H-indol-3-yl)ethyl]acetamide is CCOc1cccc(OCC(=O)NCCc2c[nH]c3ccccc23)c1.
What is the InChIKey of 2-(3-ethoxyphenoxy)-N-[2-(1H-indol-3-yl)ethyl]acetamide?
The InChIKey is KITGOVRBWMKCTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O3/c1-2-24-16-6-5-7-17(12-16)25-14-20(23)21-11-10-15-13-22-19-9-4-3-8-18(15)19/h3-9,12-13,22H,2,10-11,14H2,1H3,(H,21,23).
What are the key properties of 2-(3-ethoxyphenoxy)-N-[2-(1H-indol-3-yl)ethyl]acetamide?
2-(3-ethoxyphenoxy)-N-[2-(1H-indol-3-yl)ethyl]acetamide has a molecular weight of 338.41 g/mol, XLogP of 3.30, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethoxyphenoxy)-N-[2-(1H-indol-3-yl)ethyl]acetamide is sourced from PubChem (CID 112977733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).