4,4,5,5-tetradeuterio-1-(2-hydroxyethyl)imidazolidin-2-one

C5H10N2O2 — CID 22880561

IUPAC4,4,5,5-tetradeuterio-1-(2-hydroxyethyl)imidazolidin-2-one
SMILES[2H]C1([2H])NC(=O)N(CCO)C1([2H])[2H]
InChIInChI=1S/C5H10N2O2/c8-4-3-7-2-1-6-5(7)9/h8H,1-4H2,(H,6,9)/i1D2,2D2
InChIKeyHBAIZGPCSAAFSU-LNLMKGTHSA-N
MW134.17 g/mol
LogP-1.00
Rot. Bonds2

About 4,4,5,5-tetradeuterio-1-(2-hydroxyethyl)imidazolidin-2-one

4,4,5,5-tetradeuterio-1-(2-hydroxyethyl)imidazolidin-2-one (PubChem CID 22880561) has the molecular formula C5H10N2O2 and a molecular weight of 134.17 g/mol. Its IUPAC name is 4,4,5,5-tetradeuterio-1-(2-hydroxyethyl)imidazolidin-2-one.

Molecular Properties

Compound Name4,4,5,5-tetradeuterio-1-(2-hydroxyethyl)imidazolidin-2-one
PubChem CID22880561
Molecular FormulaC5H10N2O2
Molecular Weight134.17 g/mol
Exact Mass134.10
IUPAC Name4,4,5,5-tetradeuterio-1-(2-hydroxyethyl)imidazolidin-2-one
SMILES[2H]C1([2H])NC(=O)N(CCO)C1([2H])[2H]
InChIInChI=1S/C5H10N2O2/c8-4-3-7-2-1-6-5(7)9/h8H,1-4H2,(H,6,9)/i1D2,2D2
InChIKeyHBAIZGPCSAAFSU-LNLMKGTHSA-N
XLogP-1.00
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.17
LogP ≤ 5-1.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4,4,5,5-tetradeuterio-1-(2-hydroxyethyl)imidazolidin-2-one?
The IUPAC name of 4,4,5,5-tetradeuterio-1-(2-hydroxyethyl)imidazolidin-2-one (CID 22880561) is 4,4,5,5-tetradeuterio-1-(2-hydroxyethyl)imidazolidin-2-one.
What is the SMILES notation for 4,4,5,5-tetradeuterio-1-(2-hydroxyethyl)imidazolidin-2-one?
The canonical SMILES for 4,4,5,5-tetradeuterio-1-(2-hydroxyethyl)imidazolidin-2-one is [2H]C1([2H])NC(=O)N(CCO)C1([2H])[2H].
What is the InChIKey of 4,4,5,5-tetradeuterio-1-(2-hydroxyethyl)imidazolidin-2-one?
The InChIKey is HBAIZGPCSAAFSU-LNLMKGTHSA-N. The full InChI is InChI=1S/C5H10N2O2/c8-4-3-7-2-1-6-5(7)9/h8H,1-4H2,(H,6,9)/i1D2,2D2.
What are the key properties of 4,4,5,5-tetradeuterio-1-(2-hydroxyethyl)imidazolidin-2-one?
4,4,5,5-tetradeuterio-1-(2-hydroxyethyl)imidazolidin-2-one has a molecular weight of 134.17 g/mol, XLogP of -1.00, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4,5,5-tetradeuterio-1-(2-hydroxyethyl)imidazolidin-2-one is sourced from PubChem (CID 22880561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).