1-[2-(trifluoromethoxy)phenyl]imidazolidin-2-one

C10H9F3N2O2 — CID 115370438

IUPAC1-[2-(trifluoromethoxy)phenyl]imidazolidin-2-one
SMILESO=C1NCCN1c1ccccc1OC(F)(F)F
InChIInChI=1S/C10H9F3N2O2/c11-10(12,13)17-8-4-2-1-3-7(8)15-6-5-14-9(15)16/h1-4H,5-6H2,(H,14,16)
InChIKeyWAQLVULCORNBIJ-UHFFFAOYSA-N
MW246.19 g/mol
LogP2.11
Rot. Bonds2

About 1-[2-(trifluoromethoxy)phenyl]imidazolidin-2-one

1-[2-(trifluoromethoxy)phenyl]imidazolidin-2-one (PubChem CID 115370438) has the molecular formula C10H9F3N2O2 and a molecular weight of 246.19 g/mol. Its IUPAC name is 1-[2-(trifluoromethoxy)phenyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[2-(trifluoromethoxy)phenyl]imidazolidin-2-one
PubChem CID115370438
Molecular FormulaC10H9F3N2O2
Molecular Weight246.19 g/mol
Exact Mass246.06
IUPAC Name1-[2-(trifluoromethoxy)phenyl]imidazolidin-2-one
SMILESO=C1NCCN1c1ccccc1OC(F)(F)F
InChIInChI=1S/C10H9F3N2O2/c11-10(12,13)17-8-4-2-1-3-7(8)15-6-5-14-9(15)16/h1-4H,5-6H2,(H,14,16)
InChIKeyWAQLVULCORNBIJ-UHFFFAOYSA-N
XLogP2.11
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.19
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(trifluoromethoxy)phenyl]imidazolidin-2-one?
The IUPAC name of 1-[2-(trifluoromethoxy)phenyl]imidazolidin-2-one (CID 115370438) is 1-[2-(trifluoromethoxy)phenyl]imidazolidin-2-one.
What is the SMILES notation for 1-[2-(trifluoromethoxy)phenyl]imidazolidin-2-one?
The canonical SMILES for 1-[2-(trifluoromethoxy)phenyl]imidazolidin-2-one is O=C1NCCN1c1ccccc1OC(F)(F)F.
What is the InChIKey of 1-[2-(trifluoromethoxy)phenyl]imidazolidin-2-one?
The InChIKey is WAQLVULCORNBIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9F3N2O2/c11-10(12,13)17-8-4-2-1-3-7(8)15-6-5-14-9(15)16/h1-4H,5-6H2,(H,14,16).
What are the key properties of 1-[2-(trifluoromethoxy)phenyl]imidazolidin-2-one?
1-[2-(trifluoromethoxy)phenyl]imidazolidin-2-one has a molecular weight of 246.19 g/mol, XLogP of 2.11, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(trifluoromethoxy)phenyl]imidazolidin-2-one is sourced from PubChem (CID 115370438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).