1-acetyl-4,4-dimethylimidazolidin-2-one

C7H12N2O2 — CID 121227039

IUPAC1-acetyl-4,4-dimethylimidazolidin-2-one
SMILESCC(=O)N1CC(C)(C)NC1=O
InChIInChI=1S/C7H12N2O2/c1-5(10)9-4-7(2,3)8-6(9)11/h4H2,1-3H3,(H,8,11)
InChIKeyQEZXAMORNQOKDE-UHFFFAOYSA-N
MW156.19 g/mol
LogP0.34
Rot. Bonds

About 1-acetyl-4,4-dimethylimidazolidin-2-one

1-acetyl-4,4-dimethylimidazolidin-2-one (PubChem CID 121227039) has the molecular formula C7H12N2O2 and a molecular weight of 156.19 g/mol. Its IUPAC name is 1-acetyl-4,4-dimethylimidazolidin-2-one.

Molecular Properties

Compound Name1-acetyl-4,4-dimethylimidazolidin-2-one
PubChem CID121227039
Molecular FormulaC7H12N2O2
Molecular Weight156.19 g/mol
Exact Mass156.09
IUPAC Name1-acetyl-4,4-dimethylimidazolidin-2-one
SMILESCC(=O)N1CC(C)(C)NC1=O
InChIInChI=1S/C7H12N2O2/c1-5(10)9-4-7(2,3)8-6(9)11/h4H2,1-3H3,(H,8,11)
InChIKeyQEZXAMORNQOKDE-UHFFFAOYSA-N
XLogP0.34
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.19
LogP ≤ 50.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-acetyl-4,4-dimethylimidazolidin-2-one?
The IUPAC name of 1-acetyl-4,4-dimethylimidazolidin-2-one (CID 121227039) is 1-acetyl-4,4-dimethylimidazolidin-2-one.
What is the SMILES notation for 1-acetyl-4,4-dimethylimidazolidin-2-one?
The canonical SMILES for 1-acetyl-4,4-dimethylimidazolidin-2-one is CC(=O)N1CC(C)(C)NC1=O.
What is the InChIKey of 1-acetyl-4,4-dimethylimidazolidin-2-one?
The InChIKey is QEZXAMORNQOKDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O2/c1-5(10)9-4-7(2,3)8-6(9)11/h4H2,1-3H3,(H,8,11).
What are the key properties of 1-acetyl-4,4-dimethylimidazolidin-2-one?
1-acetyl-4,4-dimethylimidazolidin-2-one has a molecular weight of 156.19 g/mol, XLogP of 0.34, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-acetyl-4,4-dimethylimidazolidin-2-one is sourced from PubChem (CID 121227039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).