3-[4-(difluoromethoxy)phenyl]imidazolidine-2,4-dione

C10H8F2N2O3 — CID 103935816

IUPAC3-[4-(difluoromethoxy)phenyl]imidazolidine-2,4-dione
SMILESO=C1CNC(=O)N1c1ccc(OC(F)F)cc1
InChIInChI=1S/C10H8F2N2O3/c11-9(12)17-7-3-1-6(2-4-7)14-8(15)5-13-10(14)16/h1-4,9H,5H2,(H,13,16)
InChIKeyLZYQPRWIZNGYAS-UHFFFAOYSA-N
MW242.18 g/mol
LogP1.34
Rot. Bonds3

About 3-[4-(difluoromethoxy)phenyl]imidazolidine-2,4-dione

3-[4-(difluoromethoxy)phenyl]imidazolidine-2,4-dione (PubChem CID 103935816) has the molecular formula C10H8F2N2O3 and a molecular weight of 242.18 g/mol. Its IUPAC name is 3-[4-(difluoromethoxy)phenyl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name3-[4-(difluoromethoxy)phenyl]imidazolidine-2,4-dione
PubChem CID103935816
Molecular FormulaC10H8F2N2O3
Molecular Weight242.18 g/mol
Exact Mass242.05
IUPAC Name3-[4-(difluoromethoxy)phenyl]imidazolidine-2,4-dione
SMILESO=C1CNC(=O)N1c1ccc(OC(F)F)cc1
InChIInChI=1S/C10H8F2N2O3/c11-9(12)17-7-3-1-6(2-4-7)14-8(15)5-13-10(14)16/h1-4,9H,5H2,(H,13,16)
InChIKeyLZYQPRWIZNGYAS-UHFFFAOYSA-N
XLogP1.34
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.18
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

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Related Compounds

(1S,2R,6S,7R)-4-[4-(difluoromethoxy)phenyl]-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione
CID 51704517
3-[4-(difluoromethoxy)phenyl]pyrimidin-4-one
CID 58589509
3-[2-[[4-(difluoromethoxy)phenyl]methyl-methylamino]ethyl]imidazolidine-2,4-dione
CID 51076814
1-[4-(difluoromethoxy)phenyl]-3-methylpiperazine
CID 64925028
N-[4-(difluoromethoxy)phenyl]-4-(2-oxoimidazolidin-1-yl)benzamide
CID 51299065
(5E)-5-[[4-(difluoromethoxy)phenyl]methylidene]-3-(4-methylphenyl)-2-sulfanylideneimidazolidin-4-one
CID 9341847
(5Z)-5-[[4-(difluoromethoxy)phenyl]methylidene]-3-phenyl-2-sulfanylideneimidazolidin-4-one
CID 6209258
5-[4-(difluoromethoxy)phenyl]-2-methyl-4H-pyrazol-3-one
CID 114763823
2-[4-(difluoromethoxy)phenyl]-1,2,4-triazine-3,5-dione
CID 134119934
[4-(difluoromethoxy)phenyl]-[4-(4-fluorobenzoyl)piperazin-1-yl]methanone
CID 38387477
3-[4-(difluoromethoxy)phenyl]-5-[[4-(dimethylamino)phenyl]methylidene]-2-sulfanylideneimidazolidin-4-one
CID 3767852
3-[1-[4-(difluoromethoxy)phenyl]ethylidene]pyrrolidine-2,5-dione
CID 77040399

Frequently Asked Questions

What is the IUPAC name of 3-[4-(difluoromethoxy)phenyl]imidazolidine-2,4-dione?
The IUPAC name of 3-[4-(difluoromethoxy)phenyl]imidazolidine-2,4-dione (CID 103935816) is 3-[4-(difluoromethoxy)phenyl]imidazolidine-2,4-dione.
What is the SMILES notation for 3-[4-(difluoromethoxy)phenyl]imidazolidine-2,4-dione?
The canonical SMILES for 3-[4-(difluoromethoxy)phenyl]imidazolidine-2,4-dione is O=C1CNC(=O)N1c1ccc(OC(F)F)cc1.
What is the InChIKey of 3-[4-(difluoromethoxy)phenyl]imidazolidine-2,4-dione?
The InChIKey is LZYQPRWIZNGYAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8F2N2O3/c11-9(12)17-7-3-1-6(2-4-7)14-8(15)5-13-10(14)16/h1-4,9H,5H2,(H,13,16).
What are the key properties of 3-[4-(difluoromethoxy)phenyl]imidazolidine-2,4-dione?
3-[4-(difluoromethoxy)phenyl]imidazolidine-2,4-dione has a molecular weight of 242.18 g/mol, XLogP of 1.34, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(difluoromethoxy)phenyl]imidazolidine-2,4-dione is sourced from PubChem (CID 103935816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).