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

C15H20N2O2 — CID 43591658

IUPACN-(2-ethoxyethyl)-3-(1H-indol-3-yl)propanamide
SMILESCCOCCNC(=O)CCc1c[nH]c2ccccc12
InChIInChI=1S/C15H20N2O2/c1-2-19-10-9-16-15(18)8-7-12-11-17-14-6-4-3-5-13(12)14/h3-6,11,17H,2,7-10H2,1H3,(H,16,18)
InChIKeyGEQUPIBGXNQXLI-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.25
Rot. Bonds7

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

N-(2-ethoxyethyl)-3-(1H-indol-3-yl)propanamide (PubChem CID 43591658) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is N-(2-ethoxyethyl)-3-(1H-indol-3-yl)propanamide.

Molecular Properties

Compound NameN-(2-ethoxyethyl)-3-(1H-indol-3-yl)propanamide
PubChem CID43591658
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC NameN-(2-ethoxyethyl)-3-(1H-indol-3-yl)propanamide
SMILESCCOCCNC(=O)CCc1c[nH]c2ccccc12
InChIInChI=1S/C15H20N2O2/c1-2-19-10-9-16-15(18)8-7-12-11-17-14-6-4-3-5-13(12)14/h3-6,11,17H,2,7-10H2,1H3,(H,16,18)
InChIKeyGEQUPIBGXNQXLI-UHFFFAOYSA-N
XLogP2.25
TPSA54.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.25
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-ethoxyethyl)-4-(1H-indol-3-yl)butanamide
CID 43591663
3-(1H-indol-3-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 10664257
3-(1H-indol-3-yl)-N-(2-phenoxyethyl)propanamide
CID 4879910
4-(1H-indol-3-yl)-N-[2-[3-(1H-indol-3-yl)propanoylamino]ethyl]butanamide
CID 42506947
N-[2-(2-fluorophenoxy)ethyl]-3-(1H-indol-3-yl)propanamide
CID 18170635
3-(1H-indol-3-yl)-N-(2-sulfamoylethyl)propanamide
CID 43582891
N-(2-chloroprop-2-enyl)-3-(1H-indol-3-yl)propanamide
CID 115636757
N-[(2-bromophenyl)methyl]-3-(1H-indol-3-yl)propanamide
CID 70209057
3-(1H-indol-3-yl)-N-[(2-methylphenyl)methyl]propanamide
CID 17473957
N-hydroxy-3-(1H-indol-3-yl)propanamide
CID 23938574
N-(2-azidoethyl)-3-(1H-indol-3-yl)propanamide
CID 61342489
N-[2-(ethylamino)ethyl]-4-(1H-indol-3-yl)butanamide
CID 62658030

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyethyl)-3-(1H-indol-3-yl)propanamide?
The IUPAC name of N-(2-ethoxyethyl)-3-(1H-indol-3-yl)propanamide (CID 43591658) is N-(2-ethoxyethyl)-3-(1H-indol-3-yl)propanamide.
What is the SMILES notation for N-(2-ethoxyethyl)-3-(1H-indol-3-yl)propanamide?
The canonical SMILES for N-(2-ethoxyethyl)-3-(1H-indol-3-yl)propanamide is CCOCCNC(=O)CCc1c[nH]c2ccccc12.
What is the InChIKey of N-(2-ethoxyethyl)-3-(1H-indol-3-yl)propanamide?
The InChIKey is GEQUPIBGXNQXLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-2-19-10-9-16-15(18)8-7-12-11-17-14-6-4-3-5-13(12)14/h3-6,11,17H,2,7-10H2,1H3,(H,16,18).
What are the key properties of N-(2-ethoxyethyl)-3-(1H-indol-3-yl)propanamide?
N-(2-ethoxyethyl)-3-(1H-indol-3-yl)propanamide has a molecular weight of 260.34 g/mol, XLogP of 2.25, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyethyl)-3-(1H-indol-3-yl)propanamide is sourced from PubChem (CID 43591658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).