4-(fluoromethyl)-1-methylimidazolidin-2-one

C5H9FN2O — CID 67254784

IUPAC4-(fluoromethyl)-1-methylimidazolidin-2-one
SMILESCN1CC(CF)NC1=O
InChIInChI=1S/C5H9FN2O/c1-8-3-4(2-6)7-5(8)9/h4H,2-3H2,1H3,(H,7,9)
InChIKeyUZOOZTJYWUGUEE-UHFFFAOYSA-N
MW132.14 g/mol
LogP-0.02
Rot. Bonds1

About 4-(fluoromethyl)-1-methylimidazolidin-2-one

4-(fluoromethyl)-1-methylimidazolidin-2-one (PubChem CID 67254784) has the molecular formula C5H9FN2O and a molecular weight of 132.14 g/mol. Its IUPAC name is 4-(fluoromethyl)-1-methylimidazolidin-2-one.

Molecular Properties

Compound Name4-(fluoromethyl)-1-methylimidazolidin-2-one
PubChem CID67254784
Molecular FormulaC5H9FN2O
Molecular Weight132.14 g/mol
Exact Mass132.07
IUPAC Name4-(fluoromethyl)-1-methylimidazolidin-2-one
SMILESCN1CC(CF)NC1=O
InChIInChI=1S/C5H9FN2O/c1-8-3-4(2-6)7-5(8)9/h4H,2-3H2,1H3,(H,7,9)
InChIKeyUZOOZTJYWUGUEE-UHFFFAOYSA-N
XLogP-0.02
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.14
LogP ≤ 5-0.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-(fluoromethyl)-1-methylimidazolidin-2-one?
The IUPAC name of 4-(fluoromethyl)-1-methylimidazolidin-2-one (CID 67254784) is 4-(fluoromethyl)-1-methylimidazolidin-2-one.
What is the SMILES notation for 4-(fluoromethyl)-1-methylimidazolidin-2-one?
The canonical SMILES for 4-(fluoromethyl)-1-methylimidazolidin-2-one is CN1CC(CF)NC1=O.
What is the InChIKey of 4-(fluoromethyl)-1-methylimidazolidin-2-one?
The InChIKey is UZOOZTJYWUGUEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9FN2O/c1-8-3-4(2-6)7-5(8)9/h4H,2-3H2,1H3,(H,7,9).
What are the key properties of 4-(fluoromethyl)-1-methylimidazolidin-2-one?
4-(fluoromethyl)-1-methylimidazolidin-2-one has a molecular weight of 132.14 g/mol, XLogP of -0.02, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(fluoromethyl)-1-methylimidazolidin-2-one is sourced from PubChem (CID 67254784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).