5,5-dimethyl-3-[2-(2-phenoxyethoxy)ethyl]imidazolidine-2,4-dione

C15H20N2O4 — CID 2199176

IUPAC5,5-dimethyl-3-[2-(2-phenoxyethoxy)ethyl]imidazolidine-2,4-dione
SMILESCC1(C)NC(=O)N(CCOCCOc2ccccc2)C1=O
InChIInChI=1S/C15H20N2O4/c1-15(2)13(18)17(14(19)16-15)8-9-20-10-11-21-12-6-4-3-5-7-12/h3-7H,8-11H2,1-2H3,(H,16,19)
InChIKeyNFMUMXCGIBNXCM-UHFFFAOYSA-N
MW292.33 g/mol
LogP1.41
Rot. Bonds7

About 5,5-dimethyl-3-[2-(2-phenoxyethoxy)ethyl]imidazolidine-2,4-dione

5,5-dimethyl-3-[2-(2-phenoxyethoxy)ethyl]imidazolidine-2,4-dione (PubChem CID 2199176) has the molecular formula C15H20N2O4 and a molecular weight of 292.33 g/mol. Its IUPAC name is 5,5-dimethyl-3-[2-(2-phenoxyethoxy)ethyl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name5,5-dimethyl-3-[2-(2-phenoxyethoxy)ethyl]imidazolidine-2,4-dione
PubChem CID2199176
Molecular FormulaC15H20N2O4
Molecular Weight292.33 g/mol
Exact Mass292.14
IUPAC Name5,5-dimethyl-3-[2-(2-phenoxyethoxy)ethyl]imidazolidine-2,4-dione
SMILESCC1(C)NC(=O)N(CCOCCOc2ccccc2)C1=O
InChIInChI=1S/C15H20N2O4/c1-15(2)13(18)17(14(19)16-15)8-9-20-10-11-21-12-6-4-3-5-7-12/h3-7H,8-11H2,1-2H3,(H,16,19)
InChIKeyNFMUMXCGIBNXCM-UHFFFAOYSA-N
XLogP1.41
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.33
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5,5-dimethyl-3-[2-(2-phenoxyethoxy)ethyl]imidazolidine-2,4-dione?
The IUPAC name of 5,5-dimethyl-3-[2-(2-phenoxyethoxy)ethyl]imidazolidine-2,4-dione (CID 2199176) is 5,5-dimethyl-3-[2-(2-phenoxyethoxy)ethyl]imidazolidine-2,4-dione.
What is the SMILES notation for 5,5-dimethyl-3-[2-(2-phenoxyethoxy)ethyl]imidazolidine-2,4-dione?
The canonical SMILES for 5,5-dimethyl-3-[2-(2-phenoxyethoxy)ethyl]imidazolidine-2,4-dione is CC1(C)NC(=O)N(CCOCCOc2ccccc2)C1=O.
What is the InChIKey of 5,5-dimethyl-3-[2-(2-phenoxyethoxy)ethyl]imidazolidine-2,4-dione?
The InChIKey is NFMUMXCGIBNXCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O4/c1-15(2)13(18)17(14(19)16-15)8-9-20-10-11-21-12-6-4-3-5-7-12/h3-7H,8-11H2,1-2H3,(H,16,19).
What are the key properties of 5,5-dimethyl-3-[2-(2-phenoxyethoxy)ethyl]imidazolidine-2,4-dione?
5,5-dimethyl-3-[2-(2-phenoxyethoxy)ethyl]imidazolidine-2,4-dione has a molecular weight of 292.33 g/mol, XLogP of 1.41, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-dimethyl-3-[2-(2-phenoxyethoxy)ethyl]imidazolidine-2,4-dione is sourced from PubChem (CID 2199176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).