3-ethoxy-N-ethylpropanamide

C7H15NO2 — CID 58030283

IUPAC3-ethoxy-N-ethylpropanamide
SMILESCCNC(=O)CCOCC
InChIInChI=1S/C7H15NO2/c1-3-8-7(9)5-6-10-4-2/h3-6H2,1-2H3,(H,8,9)
InChIKeyYEGOEFQOEQJSRZ-UHFFFAOYSA-N
MW145.20 g/mol
LogP0.55
Rot. Bonds5

About 3-ethoxy-N-ethylpropanamide

3-ethoxy-N-ethylpropanamide (PubChem CID 58030283) has the molecular formula C7H15NO2 and a molecular weight of 145.20 g/mol. Its IUPAC name is 3-ethoxy-N-ethylpropanamide.

Molecular Properties

Compound Name3-ethoxy-N-ethylpropanamide
PubChem CID58030283
Molecular FormulaC7H15NO2
Molecular Weight145.20 g/mol
Exact Mass145.11
IUPAC Name3-ethoxy-N-ethylpropanamide
SMILESCCNC(=O)CCOCC
InChIInChI=1S/C7H15NO2/c1-3-8-7(9)5-6-10-4-2/h3-6H2,1-2H3,(H,8,9)
InChIKeyYEGOEFQOEQJSRZ-UHFFFAOYSA-N
XLogP0.55
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.20
LogP ≤ 50.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-ethyl-3-[2-(2-propoxyethoxy)ethoxy]propanamide
CID 144855445
N-ethyl-3-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanamide
CID 164717500
3-(2-aminoethoxy)-N-ethylpropanamide
CID 62343432
N-ethyl-3-[3-[3-(ethylamino)-3-oxopropoxy]-2-[[3-(ethylamino)-3-oxopropoxy]methyl]-2-methylpropoxy]propanamide
CID 134387196
3-(3-aminopropoxy)-N-ethylpropanamide
CID 62344045
3-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]-N-ethylpropanamide;ethanamine
CID 158863461
3-ethoxy-N-(2-hydroxy-2-methylpropyl)propanamide
CID 65109921
3-ethoxy-N-(2-hydroxypropyl)propanamide
CID 62589549
N-ethyl-3-octadecoxypropanamide
CID 169179965
N-(2,2-dimethoxyethyl)-3-ethoxypropanamide
CID 62966631
tert-butyl N-[2-(3-ethoxypropanoylamino)ethyl]carbamate
CID 155275245
3-ethoxy-N-pent-3-ynylpropanamide
CID 115977143

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-N-ethylpropanamide?
The IUPAC name of 3-ethoxy-N-ethylpropanamide (CID 58030283) is 3-ethoxy-N-ethylpropanamide.
What is the SMILES notation for 3-ethoxy-N-ethylpropanamide?
The canonical SMILES for 3-ethoxy-N-ethylpropanamide is CCNC(=O)CCOCC.
What is the InChIKey of 3-ethoxy-N-ethylpropanamide?
The InChIKey is YEGOEFQOEQJSRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO2/c1-3-8-7(9)5-6-10-4-2/h3-6H2,1-2H3,(H,8,9).
What are the key properties of 3-ethoxy-N-ethylpropanamide?
3-ethoxy-N-ethylpropanamide has a molecular weight of 145.20 g/mol, XLogP of 0.55, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-N-ethylpropanamide is sourced from PubChem (CID 58030283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).