2-(4-ethylanilino)-N-[2-(1H-indol-3-yl)ethyl]acetamide

C20H23N3O — CID 109002445

IUPAC2-(4-ethylanilino)-N-[2-(1H-indol-3-yl)ethyl]acetamide
SMILESCCc1ccc(NCC(=O)NCCc2c[nH]c3ccccc23)cc1
InChIInChI=1S/C20H23N3O/c1-2-15-7-9-17(10-8-15)22-14-20(24)21-12-11-16-13-23-19-6-4-3-5-18(16)19/h3-10,13,22-23H,2,11-12,14H2,1H3,(H,21,24)
InChIKeySXDROIWNRHEELM-UHFFFAOYSA-N
MW321.42 g/mol
LogP3.50
Rot. Bonds7

About 2-(4-ethylanilino)-N-[2-(1H-indol-3-yl)ethyl]acetamide

2-(4-ethylanilino)-N-[2-(1H-indol-3-yl)ethyl]acetamide (PubChem CID 109002445) has the molecular formula C20H23N3O and a molecular weight of 321.42 g/mol. Its IUPAC name is 2-(4-ethylanilino)-N-[2-(1H-indol-3-yl)ethyl]acetamide.

Molecular Properties

Compound Name2-(4-ethylanilino)-N-[2-(1H-indol-3-yl)ethyl]acetamide
PubChem CID109002445
Molecular FormulaC20H23N3O
Molecular Weight321.42 g/mol
Exact Mass321.18
IUPAC Name2-(4-ethylanilino)-N-[2-(1H-indol-3-yl)ethyl]acetamide
SMILESCCc1ccc(NCC(=O)NCCc2c[nH]c3ccccc23)cc1
InChIInChI=1S/C20H23N3O/c1-2-15-7-9-17(10-8-15)22-14-20(24)21-12-11-16-13-23-19-6-4-3-5-18(16)19/h3-10,13,22-23H,2,11-12,14H2,1H3,(H,21,24)
InChIKeySXDROIWNRHEELM-UHFFFAOYSA-N
XLogP3.50
TPSA56.92 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.42
LogP ≤ 53.50
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-acetamidoanilino)-N-[2-(1H-indol-3-yl)ethyl]acetamide
CID 109002483
2-(4-ethylphenoxy)-N-[2-(1H-indol-3-yl)ethyl]acetamide
CID 26710642
1-(4-ethylphenyl)-3-[2-(1H-indol-3-yl)ethyl]thiourea
CID 7962474
2-[2-(1H-indol-3-yl)ethylamino]-N-(2-phenylethyl)acetamide
CID 108999978
N-[2-(4-fluorophenyl)ethyl]-2-[2-(1H-indol-3-yl)ethylamino]acetamide
CID 109000531
ethyl 4-[[3-[2-(1H-indol-3-yl)ethylamino]-3-oxopropyl]amino]benzoate
CID 109027473
2-(2-fluoroanilino)-N-[2-(1H-indol-3-yl)ethyl]acetamide
CID 109002455
3-(4-acetylanilino)-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 109027454
3-(1H-indol-3-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 10664257
3-(4-ethoxyanilino)-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 109027444
2-amino-N-[2-[2-(1H-indol-3-yl)ethylamino]-2-oxoethyl]acetamide
CID 61258221
2-(2,4-difluoroanilino)-N-[2-(1H-indol-3-yl)ethyl]acetamide
CID 109002509

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethylanilino)-N-[2-(1H-indol-3-yl)ethyl]acetamide?
The IUPAC name of 2-(4-ethylanilino)-N-[2-(1H-indol-3-yl)ethyl]acetamide (CID 109002445) is 2-(4-ethylanilino)-N-[2-(1H-indol-3-yl)ethyl]acetamide.
What is the SMILES notation for 2-(4-ethylanilino)-N-[2-(1H-indol-3-yl)ethyl]acetamide?
The canonical SMILES for 2-(4-ethylanilino)-N-[2-(1H-indol-3-yl)ethyl]acetamide is CCc1ccc(NCC(=O)NCCc2c[nH]c3ccccc23)cc1.
What is the InChIKey of 2-(4-ethylanilino)-N-[2-(1H-indol-3-yl)ethyl]acetamide?
The InChIKey is SXDROIWNRHEELM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O/c1-2-15-7-9-17(10-8-15)22-14-20(24)21-12-11-16-13-23-19-6-4-3-5-18(16)19/h3-10,13,22-23H,2,11-12,14H2,1H3,(H,21,24).
What are the key properties of 2-(4-ethylanilino)-N-[2-(1H-indol-3-yl)ethyl]acetamide?
2-(4-ethylanilino)-N-[2-(1H-indol-3-yl)ethyl]acetamide has a molecular weight of 321.42 g/mol, XLogP of 3.50, 7 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethylanilino)-N-[2-(1H-indol-3-yl)ethyl]acetamide is sourced from PubChem (CID 109002445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).