1-[(4,5-dihydroxy-3-methyl-2-oxoimidazolidin-1-yl)methyl]-4,5-dihydroxy-3-methylimidazolidin-2-one

C9H16N4O6 — CID 20557106

IUPAC1-[(4,5-dihydroxy-3-methyl-2-oxoimidazolidin-1-yl)methyl]-4,5-dihydroxy-3-methylimidazolidin-2-one
SMILESCN1C(=O)N(CN2C(=O)N(C)C(O)C2O)C(O)C1O
InChIInChI=1S/C9H16N4O6/c1-10-4(14)6(16)12(8(10)18)3-13-7(17)5(15)11(2)9(13)19/h4-7,14-17H,3H2,1-2H3
InChIKeyJYXHDSBYBRDBGH-UHFFFAOYSA-N
MW276.25 g/mol
LogP-3.05
Rot. Bonds2

About 1-[(4,5-dihydroxy-3-methyl-2-oxoimidazolidin-1-yl)methyl]-4,5-dihydroxy-3-methylimidazolidin-2-one

1-[(4,5-dihydroxy-3-methyl-2-oxoimidazolidin-1-yl)methyl]-4,5-dihydroxy-3-methylimidazolidin-2-one (PubChem CID 20557106) has the molecular formula C9H16N4O6 and a molecular weight of 276.25 g/mol. Its IUPAC name is 1-[(4,5-dihydroxy-3-methyl-2-oxoimidazolidin-1-yl)methyl]-4,5-dihydroxy-3-methylimidazolidin-2-one.

Molecular Properties

Compound Name1-[(4,5-dihydroxy-3-methyl-2-oxoimidazolidin-1-yl)methyl]-4,5-dihydroxy-3-methylimidazolidin-2-one
PubChem CID20557106
Molecular FormulaC9H16N4O6
Molecular Weight276.25 g/mol
Exact Mass276.11
IUPAC Name1-[(4,5-dihydroxy-3-methyl-2-oxoimidazolidin-1-yl)methyl]-4,5-dihydroxy-3-methylimidazolidin-2-one
SMILESCN1C(=O)N(CN2C(=O)N(C)C(O)C2O)C(O)C1O
InChIInChI=1S/C9H16N4O6/c1-10-4(14)6(16)12(8(10)18)3-13-7(17)5(15)11(2)9(13)19/h4-7,14-17H,3H2,1-2H3
InChIKeyJYXHDSBYBRDBGH-UHFFFAOYSA-N
XLogP-3.05
TPSA128.02 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.25
LogP ≤ 5-3.05
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Analyze 1-[(4,5-dihydroxy-3-methyl-2-oxoimidazolidin-1-yl)methyl]-4,5-dihydroxy-3-methylimidazolidin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[(4,5-dihydroxy-3-methyl-2-oxoimidazolidin-1-yl)methyl]-4,5-dihydroxy-3-methylimidazolidin-2-one?
The IUPAC name of 1-[(4,5-dihydroxy-3-methyl-2-oxoimidazolidin-1-yl)methyl]-4,5-dihydroxy-3-methylimidazolidin-2-one (CID 20557106) is 1-[(4,5-dihydroxy-3-methyl-2-oxoimidazolidin-1-yl)methyl]-4,5-dihydroxy-3-methylimidazolidin-2-one.
What is the SMILES notation for 1-[(4,5-dihydroxy-3-methyl-2-oxoimidazolidin-1-yl)methyl]-4,5-dihydroxy-3-methylimidazolidin-2-one?
The canonical SMILES for 1-[(4,5-dihydroxy-3-methyl-2-oxoimidazolidin-1-yl)methyl]-4,5-dihydroxy-3-methylimidazolidin-2-one is CN1C(=O)N(CN2C(=O)N(C)C(O)C2O)C(O)C1O.
What is the InChIKey of 1-[(4,5-dihydroxy-3-methyl-2-oxoimidazolidin-1-yl)methyl]-4,5-dihydroxy-3-methylimidazolidin-2-one?
The InChIKey is JYXHDSBYBRDBGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4O6/c1-10-4(14)6(16)12(8(10)18)3-13-7(17)5(15)11(2)9(13)19/h4-7,14-17H,3H2,1-2H3.
What are the key properties of 1-[(4,5-dihydroxy-3-methyl-2-oxoimidazolidin-1-yl)methyl]-4,5-dihydroxy-3-methylimidazolidin-2-one?
1-[(4,5-dihydroxy-3-methyl-2-oxoimidazolidin-1-yl)methyl]-4,5-dihydroxy-3-methylimidazolidin-2-one has a molecular weight of 276.25 g/mol, XLogP of -3.05, 2 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4,5-dihydroxy-3-methyl-2-oxoimidazolidin-1-yl)methyl]-4,5-dihydroxy-3-methylimidazolidin-2-one is sourced from PubChem (CID 20557106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).