1-deuterio-4,5-dimethylimidazolidin-2-one

C5H10N2O — CID 139901387

IUPAC1-deuterio-4,5-dimethylimidazolidin-2-one
SMILES[2H]N1C(=O)NC(C)C1C
InChIInChI=1S/C5H10N2O/c1-3-4(2)7-5(8)6-3/h3-4H,1-2H3,(H2,6,7,8)/i/hD
InChIKeyFEVSXQMJLWVHDA-DYCDLGHISA-N
MW115.15 g/mol
LogP0.08
Rot. Bonds

About 1-deuterio-4,5-dimethylimidazolidin-2-one

1-deuterio-4,5-dimethylimidazolidin-2-one (PubChem CID 139901387) has the molecular formula C5H10N2O and a molecular weight of 115.15 g/mol. Its IUPAC name is 1-deuterio-4,5-dimethylimidazolidin-2-one.

Molecular Properties

Compound Name1-deuterio-4,5-dimethylimidazolidin-2-one
PubChem CID139901387
Molecular FormulaC5H10N2O
Molecular Weight115.15 g/mol
Exact Mass115.09
IUPAC Name1-deuterio-4,5-dimethylimidazolidin-2-one
SMILES[2H]N1C(=O)NC(C)C1C
InChIInChI=1S/C5H10N2O/c1-3-4(2)7-5(8)6-3/h3-4H,1-2H3,(H2,6,7,8)/i/hD
InChIKeyFEVSXQMJLWVHDA-DYCDLGHISA-N
XLogP0.08
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.15
LogP ≤ 50.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-deuterio-4,5-dimethylimidazolidin-2-one?
The IUPAC name of 1-deuterio-4,5-dimethylimidazolidin-2-one (CID 139901387) is 1-deuterio-4,5-dimethylimidazolidin-2-one.
What is the SMILES notation for 1-deuterio-4,5-dimethylimidazolidin-2-one?
The canonical SMILES for 1-deuterio-4,5-dimethylimidazolidin-2-one is [2H]N1C(=O)NC(C)C1C.
What is the InChIKey of 1-deuterio-4,5-dimethylimidazolidin-2-one?
The InChIKey is FEVSXQMJLWVHDA-DYCDLGHISA-N. The full InChI is InChI=1S/C5H10N2O/c1-3-4(2)7-5(8)6-3/h3-4H,1-2H3,(H2,6,7,8)/i/hD.
What are the key properties of 1-deuterio-4,5-dimethylimidazolidin-2-one?
1-deuterio-4,5-dimethylimidazolidin-2-one has a molecular weight of 115.15 g/mol, XLogP of 0.08, 0 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-deuterio-4,5-dimethylimidazolidin-2-one is sourced from PubChem (CID 139901387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).