1-(4-propan-2-yloxyphenyl)imidazolidine-2,4-dione

C12H14N2O3 — CID 79778090

IUPAC1-(4-propan-2-yloxyphenyl)imidazolidine-2,4-dione
SMILESCC(C)Oc1ccc(N2CC(=O)NC2=O)cc1
InChIInChI=1S/C12H14N2O3/c1-8(2)17-10-5-3-9(4-6-10)14-7-11(15)13-12(14)16/h3-6,8H,7H2,1-2H3,(H,13,15,16)
InChIKeyVIISEGFOBZDFTH-UHFFFAOYSA-N
MW234.25 g/mol
LogP1.53
Rot. Bonds3

About 1-(4-propan-2-yloxyphenyl)imidazolidine-2,4-dione

1-(4-propan-2-yloxyphenyl)imidazolidine-2,4-dione (PubChem CID 79778090) has the molecular formula C12H14N2O3 and a molecular weight of 234.25 g/mol. Its IUPAC name is 1-(4-propan-2-yloxyphenyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name1-(4-propan-2-yloxyphenyl)imidazolidine-2,4-dione
PubChem CID79778090
Molecular FormulaC12H14N2O3
Molecular Weight234.25 g/mol
Exact Mass234.10
IUPAC Name1-(4-propan-2-yloxyphenyl)imidazolidine-2,4-dione
SMILESCC(C)Oc1ccc(N2CC(=O)NC2=O)cc1
InChIInChI=1S/C12H14N2O3/c1-8(2)17-10-5-3-9(4-6-10)14-7-11(15)13-12(14)16/h3-6,8H,7H2,1-2H3,(H,13,15,16)
InChIKeyVIISEGFOBZDFTH-UHFFFAOYSA-N
XLogP1.53
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.25
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-(4-propan-2-yloxyphenyl)imidazolidine-2,4-dione?
The IUPAC name of 1-(4-propan-2-yloxyphenyl)imidazolidine-2,4-dione (CID 79778090) is 1-(4-propan-2-yloxyphenyl)imidazolidine-2,4-dione.
What is the SMILES notation for 1-(4-propan-2-yloxyphenyl)imidazolidine-2,4-dione?
The canonical SMILES for 1-(4-propan-2-yloxyphenyl)imidazolidine-2,4-dione is CC(C)Oc1ccc(N2CC(=O)NC2=O)cc1.
What is the InChIKey of 1-(4-propan-2-yloxyphenyl)imidazolidine-2,4-dione?
The InChIKey is VIISEGFOBZDFTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O3/c1-8(2)17-10-5-3-9(4-6-10)14-7-11(15)13-12(14)16/h3-6,8H,7H2,1-2H3,(H,13,15,16).
What are the key properties of 1-(4-propan-2-yloxyphenyl)imidazolidine-2,4-dione?
1-(4-propan-2-yloxyphenyl)imidazolidine-2,4-dione has a molecular weight of 234.25 g/mol, XLogP of 1.53, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-propan-2-yloxyphenyl)imidazolidine-2,4-dione is sourced from PubChem (CID 79778090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).