5-hydroxy-5-(2-methylpropyl)imidazolidine-2,4-dione

C7H12N2O3 — CID 19847219

IUPAC5-hydroxy-5-(2-methylpropyl)imidazolidine-2,4-dione
SMILESCC(C)CC1(O)NC(=O)NC1=O
InChIInChI=1S/C7H12N2O3/c1-4(2)3-7(12)5(10)8-6(11)9-7/h4,12H,3H2,1-2H3,(H2,8,9,10,11)
InChIKeyVOTJRUMOYQHLFS-UHFFFAOYSA-N
MW172.18 g/mol
LogP-0.44
Rot. Bonds2

About 5-hydroxy-5-(2-methylpropyl)imidazolidine-2,4-dione

5-hydroxy-5-(2-methylpropyl)imidazolidine-2,4-dione (PubChem CID 19847219) has the molecular formula C7H12N2O3 and a molecular weight of 172.18 g/mol. Its IUPAC name is 5-hydroxy-5-(2-methylpropyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name5-hydroxy-5-(2-methylpropyl)imidazolidine-2,4-dione
PubChem CID19847219
Molecular FormulaC7H12N2O3
Molecular Weight172.18 g/mol
Exact Mass172.08
IUPAC Name5-hydroxy-5-(2-methylpropyl)imidazolidine-2,4-dione
SMILESCC(C)CC1(O)NC(=O)NC1=O
InChIInChI=1S/C7H12N2O3/c1-4(2)3-7(12)5(10)8-6(11)9-7/h4,12H,3H2,1-2H3,(H2,8,9,10,11)
InChIKeyVOTJRUMOYQHLFS-UHFFFAOYSA-N
XLogP-0.44
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.18
LogP ≤ 5-0.44
H-Bond Donors ≤ 53
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 5-hydroxy-5-(2-methylpropyl)imidazolidine-2,4-dione?
The IUPAC name of 5-hydroxy-5-(2-methylpropyl)imidazolidine-2,4-dione (CID 19847219) is 5-hydroxy-5-(2-methylpropyl)imidazolidine-2,4-dione.
What is the SMILES notation for 5-hydroxy-5-(2-methylpropyl)imidazolidine-2,4-dione?
The canonical SMILES for 5-hydroxy-5-(2-methylpropyl)imidazolidine-2,4-dione is CC(C)CC1(O)NC(=O)NC1=O.
What is the InChIKey of 5-hydroxy-5-(2-methylpropyl)imidazolidine-2,4-dione?
The InChIKey is VOTJRUMOYQHLFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O3/c1-4(2)3-7(12)5(10)8-6(11)9-7/h4,12H,3H2,1-2H3,(H2,8,9,10,11).
What are the key properties of 5-hydroxy-5-(2-methylpropyl)imidazolidine-2,4-dione?
5-hydroxy-5-(2-methylpropyl)imidazolidine-2,4-dione has a molecular weight of 172.18 g/mol, XLogP of -0.44, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-5-(2-methylpropyl)imidazolidine-2,4-dione is sourced from PubChem (CID 19847219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).