1,4-difluoro-3-[(4-hydroxyphenyl)methyl]imidazolidin-2-one

C10H10F2N2O2 — CID 175290884

IUPAC1,4-difluoro-3-[(4-hydroxyphenyl)methyl]imidazolidin-2-one
SMILESO=C1N(F)CC(F)N1Cc1ccc(O)cc1
InChIInChI=1S/C10H10F2N2O2/c11-9-6-14(12)10(16)13(9)5-7-1-3-8(15)4-2-7/h1-4,9,15H,5-6H2
InChIKeyUIWDGDUUUNQERZ-UHFFFAOYSA-N
MW228.20 g/mol
LogP1.81
Rot. Bonds2

About 1,4-difluoro-3-[(4-hydroxyphenyl)methyl]imidazolidin-2-one

1,4-difluoro-3-[(4-hydroxyphenyl)methyl]imidazolidin-2-one (PubChem CID 175290884) has the molecular formula C10H10F2N2O2 and a molecular weight of 228.20 g/mol. Its IUPAC name is 1,4-difluoro-3-[(4-hydroxyphenyl)methyl]imidazolidin-2-one.

Molecular Properties

Compound Name1,4-difluoro-3-[(4-hydroxyphenyl)methyl]imidazolidin-2-one
PubChem CID175290884
Molecular FormulaC10H10F2N2O2
Molecular Weight228.20 g/mol
Exact Mass228.07
IUPAC Name1,4-difluoro-3-[(4-hydroxyphenyl)methyl]imidazolidin-2-one
SMILESO=C1N(F)CC(F)N1Cc1ccc(O)cc1
InChIInChI=1S/C10H10F2N2O2/c11-9-6-14(12)10(16)13(9)5-7-1-3-8(15)4-2-7/h1-4,9,15H,5-6H2
InChIKeyUIWDGDUUUNQERZ-UHFFFAOYSA-N
XLogP1.81
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.20
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-C-halo', 'substructure': 'N/A'}, {'alert_name': 'N-halo', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1,4-difluoro-3-[(4-hydroxyphenyl)methyl]imidazolidin-2-one?
The IUPAC name of 1,4-difluoro-3-[(4-hydroxyphenyl)methyl]imidazolidin-2-one (CID 175290884) is 1,4-difluoro-3-[(4-hydroxyphenyl)methyl]imidazolidin-2-one.
What is the SMILES notation for 1,4-difluoro-3-[(4-hydroxyphenyl)methyl]imidazolidin-2-one?
The canonical SMILES for 1,4-difluoro-3-[(4-hydroxyphenyl)methyl]imidazolidin-2-one is O=C1N(F)CC(F)N1Cc1ccc(O)cc1.
What is the InChIKey of 1,4-difluoro-3-[(4-hydroxyphenyl)methyl]imidazolidin-2-one?
The InChIKey is UIWDGDUUUNQERZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F2N2O2/c11-9-6-14(12)10(16)13(9)5-7-1-3-8(15)4-2-7/h1-4,9,15H,5-6H2.
What are the key properties of 1,4-difluoro-3-[(4-hydroxyphenyl)methyl]imidazolidin-2-one?
1,4-difluoro-3-[(4-hydroxyphenyl)methyl]imidazolidin-2-one has a molecular weight of 228.20 g/mol, XLogP of 1.81, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-difluoro-3-[(4-hydroxyphenyl)methyl]imidazolidin-2-one is sourced from PubChem (CID 175290884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).