2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]acetaldehyde;ethane

C10H23NO4 — CID 142368342

IUPAC2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]acetaldehyde;ethane
SMILESCC.NCCOCCOCCOCC=O
InChIInChI=1S/C8H17NO4.C2H6/c9-1-3-11-5-7-13-8-6-12-4-2-10;1-2/h2H,1,3-9H2;1-2H3
InChIKeyHMYUATVOTAFCFO-UHFFFAOYSA-N
MW221.30 g/mol
LogP0.22
Rot. Bonds10

About 2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]acetaldehyde;ethane

2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]acetaldehyde;ethane (PubChem CID 142368342) has the molecular formula C10H23NO4 and a molecular weight of 221.30 g/mol. Its IUPAC name is 2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]acetaldehyde;ethane.

Molecular Properties

Compound Name2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]acetaldehyde;ethane
PubChem CID142368342
Molecular FormulaC10H23NO4
Molecular Weight221.30 g/mol
Exact Mass221.16
IUPAC Name2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]acetaldehyde;ethane
SMILESCC.NCCOCCOCCOCC=O
InChIInChI=1S/C8H17NO4.C2H6/c9-1-3-11-5-7-13-8-6-12-4-2-10;1-2/h2H,1,3-9H2;1-2H3
InChIKeyHMYUATVOTAFCFO-UHFFFAOYSA-N
XLogP0.22
TPSA70.78 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-[2-[2-(2-oxoethoxy)ethoxy]ethoxy]acetaldehyde
CID 86256206
2-[3-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]-2-[2-[2-(2-aminoethoxy)ethoxy]ethoxymethyl]-2-methylpropoxy]acetaldehyde
CID 167072159
2-[2-[2-(aminomethoxy)ethoxy]ethoxy]acetaldehyde
CID 118439625
3-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanal
CID 145435287
2-[2-(2-methoxyethoxy)ethoxy]acetaldehyde
CID 10607071
3-(2-aminoethoxy)propanal;ethane;molecular hydrogen
CID 177180522
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]acetaldehyde
CID 159473270
2-[2-(3-methoxypropoxy)ethoxy]acetaldehyde
CID 103178884
2-[2-(2-oxoethoxy)ethoxy]ethyl carbamate
CID 89498501
2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanamine;azane
CID 174533279
ethane;2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]acetaldehyde
CID 171646622
2-(2-oxoethoxy)ethyl hypobromite
CID 87256554

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]acetaldehyde;ethane?
The IUPAC name of 2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]acetaldehyde;ethane (CID 142368342) is 2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]acetaldehyde;ethane.
What is the SMILES notation for 2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]acetaldehyde;ethane?
The canonical SMILES for 2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]acetaldehyde;ethane is CC.NCCOCCOCCOCC=O.
What is the InChIKey of 2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]acetaldehyde;ethane?
The InChIKey is HMYUATVOTAFCFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO4.C2H6/c9-1-3-11-5-7-13-8-6-12-4-2-10;1-2/h2H,1,3-9H2;1-2H3.
What are the key properties of 2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]acetaldehyde;ethane?
2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]acetaldehyde;ethane has a molecular weight of 221.30 g/mol, XLogP of 0.22, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]acetaldehyde;ethane is sourced from PubChem (CID 142368342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).