4,5-dihydroxy-1-methylimidazolidin-2-one

C4H8N2O3 — CID 15354231

IUPAC4,5-dihydroxy-1-methylimidazolidin-2-one
SMILESCN1C(=O)NC(O)C1O
InChIInChI=1S/C4H8N2O3/c1-6-3(8)2(7)5-4(6)9/h2-3,7-8H,1H3,(H,5,9)
InChIKeyFCCYTEWKVKVUEB-UHFFFAOYSA-N
MW132.12 g/mol
LogP-1.72
Rot. Bonds

About 4,5-dihydroxy-1-methylimidazolidin-2-one

4,5-dihydroxy-1-methylimidazolidin-2-one (PubChem CID 15354231) has the molecular formula C4H8N2O3 and a molecular weight of 132.12 g/mol. Its IUPAC name is 4,5-dihydroxy-1-methylimidazolidin-2-one.

Molecular Properties

Compound Name4,5-dihydroxy-1-methylimidazolidin-2-one
PubChem CID15354231
Molecular FormulaC4H8N2O3
Molecular Weight132.12 g/mol
Exact Mass132.05
IUPAC Name4,5-dihydroxy-1-methylimidazolidin-2-one
SMILESCN1C(=O)NC(O)C1O
InChIInChI=1S/C4H8N2O3/c1-6-3(8)2(7)5-4(6)9/h2-3,7-8H,1H3,(H,5,9)
InChIKeyFCCYTEWKVKVUEB-UHFFFAOYSA-N
XLogP-1.72
TPSA72.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.12
LogP ≤ 5-1.72
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4,5-dihydroxy-1-methylimidazolidin-2-one?
The IUPAC name of 4,5-dihydroxy-1-methylimidazolidin-2-one (CID 15354231) is 4,5-dihydroxy-1-methylimidazolidin-2-one.
What is the SMILES notation for 4,5-dihydroxy-1-methylimidazolidin-2-one?
The canonical SMILES for 4,5-dihydroxy-1-methylimidazolidin-2-one is CN1C(=O)NC(O)C1O.
What is the InChIKey of 4,5-dihydroxy-1-methylimidazolidin-2-one?
The InChIKey is FCCYTEWKVKVUEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8N2O3/c1-6-3(8)2(7)5-4(6)9/h2-3,7-8H,1H3,(H,5,9).
What are the key properties of 4,5-dihydroxy-1-methylimidazolidin-2-one?
4,5-dihydroxy-1-methylimidazolidin-2-one has a molecular weight of 132.12 g/mol, XLogP of -1.72, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-dihydroxy-1-methylimidazolidin-2-one is sourced from PubChem (CID 15354231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).