2-[2-(2-aminoethoxy)ethoxy]ethanamine;butanediamide

C10H24N4O4 — CID 87072841

IUPAC2-[2-(2-aminoethoxy)ethoxy]ethanamine;butanediamide
SMILESNC(=O)CCC(N)=O.NCCOCCOCCN
InChIInChI=1S/C6H16N2O2.C4H8N2O2/c7-1-3-9-5-6-10-4-2-8;5-3(7)1-2-4(6)8/h1-8H2;1-2H2,(H2,5,7)(H2,6,8)
InChIKeyWORVWDDHECILLC-UHFFFAOYSA-N
MW264.33 g/mol
LogP-2.33
Rot. Bonds10

About 2-[2-(2-aminoethoxy)ethoxy]ethanamine;butanediamide

2-[2-(2-aminoethoxy)ethoxy]ethanamine;butanediamide (PubChem CID 87072841) has the molecular formula C10H24N4O4 and a molecular weight of 264.33 g/mol. Its IUPAC name is 2-[2-(2-aminoethoxy)ethoxy]ethanamine;butanediamide.

Molecular Properties

Compound Name2-[2-(2-aminoethoxy)ethoxy]ethanamine;butanediamide
PubChem CID87072841
Molecular FormulaC10H24N4O4
Molecular Weight264.33 g/mol
Exact Mass264.18
IUPAC Name2-[2-(2-aminoethoxy)ethoxy]ethanamine;butanediamide
SMILESNC(=O)CCC(N)=O.NCCOCCOCCN
InChIInChI=1S/C6H16N2O2.C4H8N2O2/c7-1-3-9-5-6-10-4-2-8;5-3(7)1-2-4(6)8/h1-8H2;1-2H2,(H2,5,7)(H2,6,8)
InChIKeyWORVWDDHECILLC-UHFFFAOYSA-N
XLogP-2.33
TPSA156.68 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 5-2.33
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl carbamate
CID 118597467
3-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoic acid
CID 53433573
3-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoic acid
CID 119058379
3-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoic acid
CID 122361149
sodium 3-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]propanoate
CID 164599444
4-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]butanoic acid
CID 175454355
2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanamine;azane
CID 174533279
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]acetic acid
CID 155415114
3-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propanehydrazide
CID 126480543
3-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanehydrazide
CID 126651556
methyl 3-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoate
CID 100910535
methyl 3-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]propanoate;hydrochloride
CID 172915982

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-aminoethoxy)ethoxy]ethanamine;butanediamide?
The IUPAC name of 2-[2-(2-aminoethoxy)ethoxy]ethanamine;butanediamide (CID 87072841) is 2-[2-(2-aminoethoxy)ethoxy]ethanamine;butanediamide.
What is the SMILES notation for 2-[2-(2-aminoethoxy)ethoxy]ethanamine;butanediamide?
The canonical SMILES for 2-[2-(2-aminoethoxy)ethoxy]ethanamine;butanediamide is NC(=O)CCC(N)=O.NCCOCCOCCN.
What is the InChIKey of 2-[2-(2-aminoethoxy)ethoxy]ethanamine;butanediamide?
The InChIKey is WORVWDDHECILLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H16N2O2.C4H8N2O2/c7-1-3-9-5-6-10-4-2-8;5-3(7)1-2-4(6)8/h1-8H2;1-2H2,(H2,5,7)(H2,6,8).
What are the key properties of 2-[2-(2-aminoethoxy)ethoxy]ethanamine;butanediamide?
2-[2-(2-aminoethoxy)ethoxy]ethanamine;butanediamide has a molecular weight of 264.33 g/mol, XLogP of -2.33, 10 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-aminoethoxy)ethoxy]ethanamine;butanediamide is sourced from PubChem (CID 87072841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).