5-(3,4-difluorophenyl)-1-methylimidazolidin-2-one

C10H10F2N2O — CID 22993597

IUPAC5-(3,4-difluorophenyl)-1-methylimidazolidin-2-one
SMILESCN1C(=O)NCC1c1ccc(F)c(F)c1
InChIInChI=1S/C10H10F2N2O/c1-14-9(5-13-10(14)15)6-2-3-7(11)8(12)4-6/h2-4,9H,5H2,1H3,(H,13,15)
InChIKeyAQEADMOUTUKLGF-UHFFFAOYSA-N
MW212.20 g/mol
LogP1.66
Rot. Bonds1

About 5-(3,4-difluorophenyl)-1-methylimidazolidin-2-one

5-(3,4-difluorophenyl)-1-methylimidazolidin-2-one (PubChem CID 22993597) has the molecular formula C10H10F2N2O and a molecular weight of 212.20 g/mol. Its IUPAC name is 5-(3,4-difluorophenyl)-1-methylimidazolidin-2-one.

Molecular Properties

Compound Name5-(3,4-difluorophenyl)-1-methylimidazolidin-2-one
PubChem CID22993597
Molecular FormulaC10H10F2N2O
Molecular Weight212.20 g/mol
Exact Mass212.08
IUPAC Name5-(3,4-difluorophenyl)-1-methylimidazolidin-2-one
SMILESCN1C(=O)NCC1c1ccc(F)c(F)c1
InChIInChI=1S/C10H10F2N2O/c1-14-9(5-13-10(14)15)6-2-3-7(11)8(12)4-6/h2-4,9H,5H2,1H3,(H,13,15)
InChIKeyAQEADMOUTUKLGF-UHFFFAOYSA-N
XLogP1.66
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.20
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-(3,4-difluorophenyl)-1-methylimidazolidin-2-one?
The IUPAC name of 5-(3,4-difluorophenyl)-1-methylimidazolidin-2-one (CID 22993597) is 5-(3,4-difluorophenyl)-1-methylimidazolidin-2-one.
What is the SMILES notation for 5-(3,4-difluorophenyl)-1-methylimidazolidin-2-one?
The canonical SMILES for 5-(3,4-difluorophenyl)-1-methylimidazolidin-2-one is CN1C(=O)NCC1c1ccc(F)c(F)c1.
What is the InChIKey of 5-(3,4-difluorophenyl)-1-methylimidazolidin-2-one?
The InChIKey is AQEADMOUTUKLGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F2N2O/c1-14-9(5-13-10(14)15)6-2-3-7(11)8(12)4-6/h2-4,9H,5H2,1H3,(H,13,15).
What are the key properties of 5-(3,4-difluorophenyl)-1-methylimidazolidin-2-one?
5-(3,4-difluorophenyl)-1-methylimidazolidin-2-one has a molecular weight of 212.20 g/mol, XLogP of 1.66, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3,4-difluorophenyl)-1-methylimidazolidin-2-one is sourced from PubChem (CID 22993597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).