1-(1-hydroxyethyl)piperazine-2,5-dione

C6H10N2O3 — CID 15646783

IUPAC1-(1-hydroxyethyl)piperazine-2,5-dione
SMILESCC(O)N1CC(=O)NCC1=O
InChIInChI=1S/C6H10N2O3/c1-4(9)8-3-5(10)7-2-6(8)11/h4,9H,2-3H2,1H3,(H,7,10)
InChIKeyKUEOKSQVFLNFKK-UHFFFAOYSA-N
MW158.16 g/mol
LogP-1.72
Rot. Bonds1

About 1-(1-hydroxyethyl)piperazine-2,5-dione

1-(1-hydroxyethyl)piperazine-2,5-dione (PubChem CID 15646783) has the molecular formula C6H10N2O3 and a molecular weight of 158.16 g/mol. Its IUPAC name is 1-(1-hydroxyethyl)piperazine-2,5-dione.

Molecular Properties

Compound Name1-(1-hydroxyethyl)piperazine-2,5-dione
PubChem CID15646783
Molecular FormulaC6H10N2O3
Molecular Weight158.16 g/mol
Exact Mass158.07
IUPAC Name1-(1-hydroxyethyl)piperazine-2,5-dione
SMILESCC(O)N1CC(=O)NCC1=O
InChIInChI=1S/C6H10N2O3/c1-4(9)8-3-5(10)7-2-6(8)11/h4,9H,2-3H2,1H3,(H,7,10)
InChIKeyKUEOKSQVFLNFKK-UHFFFAOYSA-N
XLogP-1.72
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.16
LogP ≤ 5-1.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-Ethyl-2,3-piperazinedione
CID 108812
N-(2-hydroxyethyl)-2-[(2-hydroxyethyl)amino]acetamide
CID 53940579
2,3-Piperazinedione, 1-methyl-
CID 3042433
1-Methylpiperazine-2,5-dione
CID 260137
1-Methyl-3-oxopiperazine
CID 13704283
2,3-Piperazinedione, 1-propyl-
CID 3042434
1-Methylpiperazin-2-one
CID 4399042
2-(2-Oxopiperazin-1-yl)acetamide
CID 45099465
2-Piperazinone, 4-(2-hydroxyethyl)-
CID 1514166
1-Ethylpiperazin-2-one
CID 9877366
2-Hydroxy-1-(piperazin-1-yl)ethan-1-one
CID 18506884
1-(2-Hydroxyethyl)piperazin-2-one hydrochloride
CID 54595961

Frequently Asked Questions

What is the IUPAC name of 1-(1-hydroxyethyl)piperazine-2,5-dione?
The IUPAC name of 1-(1-hydroxyethyl)piperazine-2,5-dione (CID 15646783) is 1-(1-hydroxyethyl)piperazine-2,5-dione.
What is the SMILES notation for 1-(1-hydroxyethyl)piperazine-2,5-dione?
The canonical SMILES for 1-(1-hydroxyethyl)piperazine-2,5-dione is CC(O)N1CC(=O)NCC1=O.
What is the InChIKey of 1-(1-hydroxyethyl)piperazine-2,5-dione?
The InChIKey is KUEOKSQVFLNFKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O3/c1-4(9)8-3-5(10)7-2-6(8)11/h4,9H,2-3H2,1H3,(H,7,10).
What are the key properties of 1-(1-hydroxyethyl)piperazine-2,5-dione?
1-(1-hydroxyethyl)piperazine-2,5-dione has a molecular weight of 158.16 g/mol, XLogP of -1.72, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-hydroxyethyl)piperazine-2,5-dione is sourced from PubChem (CID 15646783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).