1,3-diacetyl-4,5-dihydroxyimidazolidin-2-one

C7H10N2O5 — CID 4617274

IUPAC1,3-diacetyl-4,5-dihydroxyimidazolidin-2-one
SMILESCC(=O)N1C(=O)N(C(C)=O)C(O)C1O
InChIInChI=1S/C7H10N2O5/c1-3(10)8-5(12)6(13)9(4(2)11)7(8)14/h5-6,12-13H,1-2H3
InChIKeyWNAHKWXAFJUDOZ-UHFFFAOYSA-N
MW202.17 g/mol
LogP-1.55
Rot. Bonds

About 1,3-diacetyl-4,5-dihydroxyimidazolidin-2-one

1,3-diacetyl-4,5-dihydroxyimidazolidin-2-one (PubChem CID 4617274) has the molecular formula C7H10N2O5 and a molecular weight of 202.17 g/mol. Its IUPAC name is 1,3-diacetyl-4,5-dihydroxyimidazolidin-2-one.

Molecular Properties

Compound Name1,3-diacetyl-4,5-dihydroxyimidazolidin-2-one
PubChem CID4617274
Molecular FormulaC7H10N2O5
Molecular Weight202.17 g/mol
Exact Mass202.06
IUPAC Name1,3-diacetyl-4,5-dihydroxyimidazolidin-2-one
SMILESCC(=O)N1C(=O)N(C(C)=O)C(O)C1O
InChIInChI=1S/C7H10N2O5/c1-3(10)8-5(12)6(13)9(4(2)11)7(8)14/h5-6,12-13H,1-2H3
InChIKeyWNAHKWXAFJUDOZ-UHFFFAOYSA-N
XLogP-1.55
TPSA98.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.17
LogP ≤ 5-1.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1,3-diacetyl-4,5-dihydroxyimidazolidin-2-one?
The IUPAC name of 1,3-diacetyl-4,5-dihydroxyimidazolidin-2-one (CID 4617274) is 1,3-diacetyl-4,5-dihydroxyimidazolidin-2-one.
What is the SMILES notation for 1,3-diacetyl-4,5-dihydroxyimidazolidin-2-one?
The canonical SMILES for 1,3-diacetyl-4,5-dihydroxyimidazolidin-2-one is CC(=O)N1C(=O)N(C(C)=O)C(O)C1O.
What is the InChIKey of 1,3-diacetyl-4,5-dihydroxyimidazolidin-2-one?
The InChIKey is WNAHKWXAFJUDOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O5/c1-3(10)8-5(12)6(13)9(4(2)11)7(8)14/h5-6,12-13H,1-2H3.
What are the key properties of 1,3-diacetyl-4,5-dihydroxyimidazolidin-2-one?
1,3-diacetyl-4,5-dihydroxyimidazolidin-2-one has a molecular weight of 202.17 g/mol, XLogP of -1.55, 0 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-diacetyl-4,5-dihydroxyimidazolidin-2-one is sourced from PubChem (CID 4617274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).