3-(2-oxoimidazolidin-1-yl)-1-(3-oxo-1H-pyrazol-2-yl)imidazolidine-2,4-dione

C9H10N6O4 — CID 159953600

IUPAC3-(2-oxoimidazolidin-1-yl)-1-(3-oxo-1H-pyrazol-2-yl)imidazolidine-2,4-dione
SMILESO=C1NCCN1N1C(=O)CN(n2[nH]ccc2=O)C1=O
InChIInChI=1S/C9H10N6O4/c16-6-1-2-11-15(6)13-5-7(17)14(9(13)19)12-4-3-10-8(12)18/h1-2,11H,3-5H2,(H,10,18)
InChIKeyWRSNRDKAQFLXFH-UHFFFAOYSA-N
MW266.22 g/mol
LogP-1.98
Rot. Bonds2

About 3-(2-oxoimidazolidin-1-yl)-1-(3-oxo-1H-pyrazol-2-yl)imidazolidine-2,4-dione

3-(2-oxoimidazolidin-1-yl)-1-(3-oxo-1H-pyrazol-2-yl)imidazolidine-2,4-dione (PubChem CID 159953600) has the molecular formula C9H10N6O4 and a molecular weight of 266.22 g/mol. Its IUPAC name is 3-(2-oxoimidazolidin-1-yl)-1-(3-oxo-1H-pyrazol-2-yl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name3-(2-oxoimidazolidin-1-yl)-1-(3-oxo-1H-pyrazol-2-yl)imidazolidine-2,4-dione
PubChem CID159953600
Molecular FormulaC9H10N6O4
Molecular Weight266.22 g/mol
Exact Mass266.08
IUPAC Name3-(2-oxoimidazolidin-1-yl)-1-(3-oxo-1H-pyrazol-2-yl)imidazolidine-2,4-dione
SMILESO=C1NCCN1N1C(=O)CN(n2[nH]ccc2=O)C1=O
InChIInChI=1S/C9H10N6O4/c16-6-1-2-11-15(6)13-5-7(17)14(9(13)19)12-4-3-10-8(12)18/h1-2,11H,3-5H2,(H,10,18)
InChIKeyWRSNRDKAQFLXFH-UHFFFAOYSA-N
XLogP-1.98
TPSA110.75 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.22
LogP ≤ 5-1.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-(2-oxoimidazolidin-1-yl)-1-(3-oxo-1H-pyrazol-2-yl)imidazolidine-2,4-dione?
The IUPAC name of 3-(2-oxoimidazolidin-1-yl)-1-(3-oxo-1H-pyrazol-2-yl)imidazolidine-2,4-dione (CID 159953600) is 3-(2-oxoimidazolidin-1-yl)-1-(3-oxo-1H-pyrazol-2-yl)imidazolidine-2,4-dione.
What is the SMILES notation for 3-(2-oxoimidazolidin-1-yl)-1-(3-oxo-1H-pyrazol-2-yl)imidazolidine-2,4-dione?
The canonical SMILES for 3-(2-oxoimidazolidin-1-yl)-1-(3-oxo-1H-pyrazol-2-yl)imidazolidine-2,4-dione is O=C1NCCN1N1C(=O)CN(n2[nH]ccc2=O)C1=O.
What is the InChIKey of 3-(2-oxoimidazolidin-1-yl)-1-(3-oxo-1H-pyrazol-2-yl)imidazolidine-2,4-dione?
The InChIKey is WRSNRDKAQFLXFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N6O4/c16-6-1-2-11-15(6)13-5-7(17)14(9(13)19)12-4-3-10-8(12)18/h1-2,11H,3-5H2,(H,10,18).
What are the key properties of 3-(2-oxoimidazolidin-1-yl)-1-(3-oxo-1H-pyrazol-2-yl)imidazolidine-2,4-dione?
3-(2-oxoimidazolidin-1-yl)-1-(3-oxo-1H-pyrazol-2-yl)imidazolidine-2,4-dione has a molecular weight of 266.22 g/mol, XLogP of -1.98, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-oxoimidazolidin-1-yl)-1-(3-oxo-1H-pyrazol-2-yl)imidazolidine-2,4-dione is sourced from PubChem (CID 159953600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).