1-[2-[1-(2,4-difluorophenyl)-5-fluoroindazol-3-yl]oxyethyl]imidazolidin-2-one

C18H15F3N4O2 — CID 127046802

IUPAC1-[2-[1-(2,4-difluorophenyl)-5-fluoroindazol-3-yl]oxyethyl]imidazolidin-2-one
SMILESO=C1NCCN1CCOc1nn(-c2ccc(F)cc2F)c2ccc(F)cc12
InChIInChI=1S/C18H15F3N4O2/c19-11-1-3-15-13(9-11)17(27-8-7-24-6-5-22-18(24)26)23-25(15)16-4-2-12(20)10-14(16)21/h1-4,9-10H,5-8H2,(H,22,26)
InChIKeyJGWFEASWZPTQCO-UHFFFAOYSA-N
MW376.34 g/mol
LogP2.85
Rot. Bonds5

About 1-[2-[1-(2,4-difluorophenyl)-5-fluoroindazol-3-yl]oxyethyl]imidazolidin-2-one

1-[2-[1-(2,4-difluorophenyl)-5-fluoroindazol-3-yl]oxyethyl]imidazolidin-2-one (PubChem CID 127046802) has the molecular formula C18H15F3N4O2 and a molecular weight of 376.34 g/mol. Its IUPAC name is 1-[2-[1-(2,4-difluorophenyl)-5-fluoroindazol-3-yl]oxyethyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[2-[1-(2,4-difluorophenyl)-5-fluoroindazol-3-yl]oxyethyl]imidazolidin-2-one
PubChem CID127046802
Molecular FormulaC18H15F3N4O2
Molecular Weight376.34 g/mol
Exact Mass376.11
IUPAC Name1-[2-[1-(2,4-difluorophenyl)-5-fluoroindazol-3-yl]oxyethyl]imidazolidin-2-one
SMILESO=C1NCCN1CCOc1nn(-c2ccc(F)cc2F)c2ccc(F)cc12
InChIInChI=1S/C18H15F3N4O2/c19-11-1-3-15-13(9-11)17(27-8-7-24-6-5-22-18(24)26)23-25(15)16-4-2-12(20)10-14(16)21/h1-4,9-10H,5-8H2,(H,22,26)
InChIKeyJGWFEASWZPTQCO-UHFFFAOYSA-N
XLogP2.85
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.34
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[2-[1-(2,4-difluorophenyl)-5-fluoroindazol-3-yl]oxyethyl]imidazolidin-2-one?
The IUPAC name of 1-[2-[1-(2,4-difluorophenyl)-5-fluoroindazol-3-yl]oxyethyl]imidazolidin-2-one (CID 127046802) is 1-[2-[1-(2,4-difluorophenyl)-5-fluoroindazol-3-yl]oxyethyl]imidazolidin-2-one.
What is the SMILES notation for 1-[2-[1-(2,4-difluorophenyl)-5-fluoroindazol-3-yl]oxyethyl]imidazolidin-2-one?
The canonical SMILES for 1-[2-[1-(2,4-difluorophenyl)-5-fluoroindazol-3-yl]oxyethyl]imidazolidin-2-one is O=C1NCCN1CCOc1nn(-c2ccc(F)cc2F)c2ccc(F)cc12.
What is the InChIKey of 1-[2-[1-(2,4-difluorophenyl)-5-fluoroindazol-3-yl]oxyethyl]imidazolidin-2-one?
The InChIKey is JGWFEASWZPTQCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15F3N4O2/c19-11-1-3-15-13(9-11)17(27-8-7-24-6-5-22-18(24)26)23-25(15)16-4-2-12(20)10-14(16)21/h1-4,9-10H,5-8H2,(H,22,26).
What are the key properties of 1-[2-[1-(2,4-difluorophenyl)-5-fluoroindazol-3-yl]oxyethyl]imidazolidin-2-one?
1-[2-[1-(2,4-difluorophenyl)-5-fluoroindazol-3-yl]oxyethyl]imidazolidin-2-one has a molecular weight of 376.34 g/mol, XLogP of 2.85, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[1-(2,4-difluorophenyl)-5-fluoroindazol-3-yl]oxyethyl]imidazolidin-2-one is sourced from PubChem (CID 127046802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).