1,5,5-trimethyl-3-propan-2-ylimidazolidine-2,4-dione

C9H16N2O2 — CID 14975700

IUPAC1,5,5-trimethyl-3-propan-2-ylimidazolidine-2,4-dione
SMILESCC(C)N1C(=O)N(C)C(C)(C)C1=O
InChIInChI=1S/C9H16N2O2/c1-6(2)11-7(12)9(3,4)10(5)8(11)13/h6H,1-5H3
InChIKeySOJHVQGQLLZANG-UHFFFAOYSA-N
MW184.24 g/mol
LogP1.07
Rot. Bonds1

About 1,5,5-trimethyl-3-propan-2-ylimidazolidine-2,4-dione

1,5,5-trimethyl-3-propan-2-ylimidazolidine-2,4-dione (PubChem CID 14975700) has the molecular formula C9H16N2O2 and a molecular weight of 184.24 g/mol. Its IUPAC name is 1,5,5-trimethyl-3-propan-2-ylimidazolidine-2,4-dione.

Molecular Properties

Compound Name1,5,5-trimethyl-3-propan-2-ylimidazolidine-2,4-dione
PubChem CID14975700
Molecular FormulaC9H16N2O2
Molecular Weight184.24 g/mol
Exact Mass184.12
IUPAC Name1,5,5-trimethyl-3-propan-2-ylimidazolidine-2,4-dione
SMILESCC(C)N1C(=O)N(C)C(C)(C)C1=O
InChIInChI=1S/C9H16N2O2/c1-6(2)11-7(12)9(3,4)10(5)8(11)13/h6H,1-5H3
InChIKeySOJHVQGQLLZANG-UHFFFAOYSA-N
XLogP1.07
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.24
LogP ≤ 51.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,5,5-trimethyl-3-propan-2-ylimidazolidine-2,4-dione?
The IUPAC name of 1,5,5-trimethyl-3-propan-2-ylimidazolidine-2,4-dione (CID 14975700) is 1,5,5-trimethyl-3-propan-2-ylimidazolidine-2,4-dione.
What is the SMILES notation for 1,5,5-trimethyl-3-propan-2-ylimidazolidine-2,4-dione?
The canonical SMILES for 1,5,5-trimethyl-3-propan-2-ylimidazolidine-2,4-dione is CC(C)N1C(=O)N(C)C(C)(C)C1=O.
What is the InChIKey of 1,5,5-trimethyl-3-propan-2-ylimidazolidine-2,4-dione?
The InChIKey is SOJHVQGQLLZANG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O2/c1-6(2)11-7(12)9(3,4)10(5)8(11)13/h6H,1-5H3.
What are the key properties of 1,5,5-trimethyl-3-propan-2-ylimidazolidine-2,4-dione?
1,5,5-trimethyl-3-propan-2-ylimidazolidine-2,4-dione has a molecular weight of 184.24 g/mol, XLogP of 1.07, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5,5-trimethyl-3-propan-2-ylimidazolidine-2,4-dione is sourced from PubChem (CID 14975700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).