3-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]-N-ethylpropanamide;ethanamine

C13H31N3O4 — CID 158863461

IUPAC3-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]-N-ethylpropanamide;ethanamine
SMILESCCN.CCNC(=O)CCOCCOCCOCCN
InChIInChI=1S/C11H24N2O4.C2H7N/c1-2-13-11(14)3-5-15-7-9-17-10-8-16-6-4-12;1-2-3/h2-10,12H2,1H3,(H,13,14);2-3H2,1H3
InChIKeyJAXXQYAJKUBNFZ-UHFFFAOYSA-N
MW293.41 g/mol
LogP-0.51
Rot. Bonds12

About 3-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]-N-ethylpropanamide;ethanamine

3-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]-N-ethylpropanamide;ethanamine (PubChem CID 158863461) has the molecular formula C13H31N3O4 and a molecular weight of 293.41 g/mol. Its IUPAC name is 3-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]-N-ethylpropanamide;ethanamine.

Molecular Properties

Compound Name3-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]-N-ethylpropanamide;ethanamine
PubChem CID158863461
Molecular FormulaC13H31N3O4
Molecular Weight293.41 g/mol
Exact Mass293.23
IUPAC Name3-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]-N-ethylpropanamide;ethanamine
SMILESCCN.CCNC(=O)CCOCCOCCOCCN
InChIInChI=1S/C11H24N2O4.C2H7N/c1-2-13-11(14)3-5-15-7-9-17-10-8-16-6-4-12;1-2-3/h2-10,12H2,1H3,(H,13,14);2-3H2,1H3
InChIKeyJAXXQYAJKUBNFZ-UHFFFAOYSA-N
XLogP-0.51
TPSA108.83 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds12
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.41
LogP ≤ 5-0.51
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

3-(2-aminoethoxy)-N-ethylpropanamide
CID 62343432
3-(3-aminopropoxy)-N-ethylpropanamide
CID 62344045
N-ethyl-3-[2-(2-propoxyethoxy)ethoxy]propanamide
CID 144855445
3-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-N-propylpropanamide
CID 176761961
N-ethyl-3-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanamide
CID 164717500
3-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-N-butylpropanamide
CID 171850519
N-[2-[2-[3-(2-aminoethoxy)propanoylamino]ethoxy]ethyl]butanamide
CID 168852472
2-(2-aminoethoxy)-N-ethylacetamide
CID 62343422
3-ethoxy-N-ethylpropanamide
CID 58030283
2-[2-[2-[[2-[2-(2-aminoethoxy)ethoxy]acetyl]amino]ethoxy]ethoxy]-N-ethylacetamide
CID 123400101
2-[3-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]propanoylamino]acetic acid;methoxymethane
CID 172598015
3-[2-(2-aminoethoxy)ethoxy]-N-[2-[2-(3-oxobutoxy)ethoxy]ethyl]propanamide
CID 145049533

Frequently Asked Questions

What is the IUPAC name of 3-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]-N-ethylpropanamide;ethanamine?
The IUPAC name of 3-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]-N-ethylpropanamide;ethanamine (CID 158863461) is 3-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]-N-ethylpropanamide;ethanamine.
What is the SMILES notation for 3-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]-N-ethylpropanamide;ethanamine?
The canonical SMILES for 3-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]-N-ethylpropanamide;ethanamine is CCN.CCNC(=O)CCOCCOCCOCCN.
What is the InChIKey of 3-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]-N-ethylpropanamide;ethanamine?
The InChIKey is JAXXQYAJKUBNFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O4.C2H7N/c1-2-13-11(14)3-5-15-7-9-17-10-8-16-6-4-12;1-2-3/h2-10,12H2,1H3,(H,13,14);2-3H2,1H3.
What are the key properties of 3-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]-N-ethylpropanamide;ethanamine?
3-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]-N-ethylpropanamide;ethanamine has a molecular weight of 293.41 g/mol, XLogP of -0.51, 12 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]-N-ethylpropanamide;ethanamine is sourced from PubChem (CID 158863461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).