1-[2-(2-hydroxyethoxy)ethyl]piperazine-2,6-dione

C8H14N2O4 — CID 66063429

IUPAC1-[2-(2-hydroxyethoxy)ethyl]piperazine-2,6-dione
SMILESO=C1CNCC(=O)N1CCOCCO
InChIInChI=1S/C8H14N2O4/c11-2-4-14-3-1-10-7(12)5-9-6-8(10)13/h9,11H,1-6H2
InChIKeyGOKBSTBXXHQNRC-UHFFFAOYSA-N
MW202.21 g/mol
LogP-2.05
Rot. Bonds5

About 1-[2-(2-hydroxyethoxy)ethyl]piperazine-2,6-dione

1-[2-(2-hydroxyethoxy)ethyl]piperazine-2,6-dione (PubChem CID 66063429) has the molecular formula C8H14N2O4 and a molecular weight of 202.21 g/mol. Its IUPAC name is 1-[2-(2-hydroxyethoxy)ethyl]piperazine-2,6-dione.

Molecular Properties

Compound Name1-[2-(2-hydroxyethoxy)ethyl]piperazine-2,6-dione
PubChem CID66063429
Molecular FormulaC8H14N2O4
Molecular Weight202.21 g/mol
Exact Mass202.10
IUPAC Name1-[2-(2-hydroxyethoxy)ethyl]piperazine-2,6-dione
SMILESO=C1CNCC(=O)N1CCOCCO
InChIInChI=1S/C8H14N2O4/c11-2-4-14-3-1-10-7(12)5-9-6-8(10)13/h9,11H,1-6H2
InChIKeyGOKBSTBXXHQNRC-UHFFFAOYSA-N
XLogP-2.05
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.21
LogP ≤ 5-2.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

1-(3-hydroxypropyl)piperazine-2,6-dione
CID 66062838
2,6-bis[2-(2-hydroxyethoxy)ethyl]-3a,4,4a,7a,8,8a-hexahydropyrrolo[3,4-f]isoindole-1,3,5,7-tetrone
CID 89453005
1-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]pyrrole-2,5-dione
CID 137334013
1-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]pyrrole-2,5-dione
CID 137334014
1-(2-phenoxyethyl)piperazine-2,6-dione
CID 66062056
1-(3-chloropropyl)piperazine-2,6-dione
CID 21245750
5-cyclobutylidene-1-[2-(2-hydroxyethoxy)ethyl]pyrrol-2-one
CID 177002874
2-[2-(2-hydroxyethoxy)ethyl]-1,5,6,7,8,8a-hexahydroimidazo[1,5-a]pyrazin-3-one
CID 79091374
1-[2-(4-bromophenoxy)ethyl]piperazine-2,6-dione
CID 66062841
2-[2-(2-hydroxyethoxy)ethyl]-1,6,7,8,9,9a-hexahydropyrazino[1,2-a]pyrazine-3,4-dione
CID 80733133
3-[2-(2-hydroxyethoxy)ethyl]-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-one
CID 103483787
1-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl]-4-sulfanylpyrrolidin-2-one
CID 168709349

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-hydroxyethoxy)ethyl]piperazine-2,6-dione?
The IUPAC name of 1-[2-(2-hydroxyethoxy)ethyl]piperazine-2,6-dione (CID 66063429) is 1-[2-(2-hydroxyethoxy)ethyl]piperazine-2,6-dione.
What is the SMILES notation for 1-[2-(2-hydroxyethoxy)ethyl]piperazine-2,6-dione?
The canonical SMILES for 1-[2-(2-hydroxyethoxy)ethyl]piperazine-2,6-dione is O=C1CNCC(=O)N1CCOCCO.
What is the InChIKey of 1-[2-(2-hydroxyethoxy)ethyl]piperazine-2,6-dione?
The InChIKey is GOKBSTBXXHQNRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O4/c11-2-4-14-3-1-10-7(12)5-9-6-8(10)13/h9,11H,1-6H2.
What are the key properties of 1-[2-(2-hydroxyethoxy)ethyl]piperazine-2,6-dione?
1-[2-(2-hydroxyethoxy)ethyl]piperazine-2,6-dione has a molecular weight of 202.21 g/mol, XLogP of -2.05, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-hydroxyethoxy)ethyl]piperazine-2,6-dione is sourced from PubChem (CID 66063429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).