2-(2,4-dioxoimidazolidin-1-yl)acetic acid

C5H6N2O4 — CID 3159673

IUPAC2-(2,4-dioxoimidazolidin-1-yl)acetic acid
SMILESO=C(O)CN1CC(=O)NC1=O
InChIInChI=1S/C5H6N2O4/c8-3-1-7(2-4(9)10)5(11)6-3/h1-2H2,(H,9,10)(H,6,8,11)
InChIKeyMYXWHYDWUWIFRA-UHFFFAOYSA-N
MW158.11 g/mol
LogP-1.38
Rot. Bonds2

About 2-(2,4-dioxoimidazolidin-1-yl)acetic acid

2-(2,4-dioxoimidazolidin-1-yl)acetic acid (PubChem CID 3159673) has the molecular formula C5H6N2O4 and a molecular weight of 158.11 g/mol. Its IUPAC name is 2-(2,4-dioxoimidazolidin-1-yl)acetic acid.

Molecular Properties

Compound Name2-(2,4-dioxoimidazolidin-1-yl)acetic acid
PubChem CID3159673
Molecular FormulaC5H6N2O4
Molecular Weight158.11 g/mol
Exact Mass158.03
IUPAC Name2-(2,4-dioxoimidazolidin-1-yl)acetic acid
SMILESO=C(O)CN1CC(=O)NC1=O
InChIInChI=1S/C5H6N2O4/c8-3-1-7(2-4(9)10)5(11)6-3/h1-2H2,(H,9,10)(H,6,8,11)
InChIKeyMYXWHYDWUWIFRA-UHFFFAOYSA-N
XLogP-1.38
TPSA86.71 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.11
LogP ≤ 5-1.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dioxoimidazolidin-1-yl)acetic acid?
The IUPAC name of 2-(2,4-dioxoimidazolidin-1-yl)acetic acid (CID 3159673) is 2-(2,4-dioxoimidazolidin-1-yl)acetic acid.
What is the SMILES notation for 2-(2,4-dioxoimidazolidin-1-yl)acetic acid?
The canonical SMILES for 2-(2,4-dioxoimidazolidin-1-yl)acetic acid is O=C(O)CN1CC(=O)NC1=O.
What is the InChIKey of 2-(2,4-dioxoimidazolidin-1-yl)acetic acid?
The InChIKey is MYXWHYDWUWIFRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6N2O4/c8-3-1-7(2-4(9)10)5(11)6-3/h1-2H2,(H,9,10)(H,6,8,11).
What are the key properties of 2-(2,4-dioxoimidazolidin-1-yl)acetic acid?
2-(2,4-dioxoimidazolidin-1-yl)acetic acid has a molecular weight of 158.11 g/mol, XLogP of -1.38, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dioxoimidazolidin-1-yl)acetic acid is sourced from PubChem (CID 3159673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).