5-(1-hydroxy-2-methylpropyl)imidazolidine-2,4-dione

C7H12N2O3 — CID 67857556

IUPAC5-(1-hydroxy-2-methylpropyl)imidazolidine-2,4-dione
SMILESCC(C)C(O)C1NC(=O)NC1=O
InChIInChI=1S/C7H12N2O3/c1-3(2)5(10)4-6(11)9-7(12)8-4/h3-5,10H,1-2H3,(H2,8,9,11,12)
InChIKeyOXAFCFYZLFOZDK-UHFFFAOYSA-N
MW172.18 g/mol
LogP-0.79
Rot. Bonds2

About 5-(1-hydroxy-2-methylpropyl)imidazolidine-2,4-dione

5-(1-hydroxy-2-methylpropyl)imidazolidine-2,4-dione (PubChem CID 67857556) has the molecular formula C7H12N2O3 and a molecular weight of 172.18 g/mol. Its IUPAC name is 5-(1-hydroxy-2-methylpropyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name5-(1-hydroxy-2-methylpropyl)imidazolidine-2,4-dione
PubChem CID67857556
Molecular FormulaC7H12N2O3
Molecular Weight172.18 g/mol
Exact Mass172.08
IUPAC Name5-(1-hydroxy-2-methylpropyl)imidazolidine-2,4-dione
SMILESCC(C)C(O)C1NC(=O)NC1=O
InChIInChI=1S/C7H12N2O3/c1-3(2)5(10)4-6(11)9-7(12)8-4/h3-5,10H,1-2H3,(H2,8,9,11,12)
InChIKeyOXAFCFYZLFOZDK-UHFFFAOYSA-N
XLogP-0.79
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 ≤ 5-0.79
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(2,5-dioxoimidazolidin-4-yl)propanal
CID 88783473
5-(1-hydroxy-2-methylidenebut-3-enyl)imidazolidine-2,4-dione
CID 142170845
5-(4-methylpentan-2-yl)imidazolidine-2,4-dione
CID 130160588
5-pentan-3-ylimidazolidine-2,4-dione
CID 11435187
5-(1,3-dichloro-5-methylhexyl)imidazolidine-2,4-dione
CID 68523936
5-dec-9-en-2-ylimidazolidine-2,4-dione
CID 67842893
1,3-dimethyl-5-propan-2-ylimidazolidine-2,4-dione;methane;5-propan-2-ylimidazolidine-2,4-dione
CID 162272241
(5S)-5-hydroxyimidazolidine-2,4-dione
CID 40649061
5-(2-amino-1-phenylethyl)imidazolidine-2,4-dione
CID 69398064
3-(2,5-dioxoimidazolidin-4-yl)-2-methylpropanoic acid
CID 121449082
N-[(1R,2R)-1-(2,5-dioxoimidazolidin-4-yl)-2-hydroxypropyl]-4-(2-phenylethynyl)benzamide
CID 24888273
5-prop-1-en-2-ylimidazolidine-2,4-dione
CID 152892368

Frequently Asked Questions

What is the IUPAC name of 5-(1-hydroxy-2-methylpropyl)imidazolidine-2,4-dione?
The IUPAC name of 5-(1-hydroxy-2-methylpropyl)imidazolidine-2,4-dione (CID 67857556) is 5-(1-hydroxy-2-methylpropyl)imidazolidine-2,4-dione.
What is the SMILES notation for 5-(1-hydroxy-2-methylpropyl)imidazolidine-2,4-dione?
The canonical SMILES for 5-(1-hydroxy-2-methylpropyl)imidazolidine-2,4-dione is CC(C)C(O)C1NC(=O)NC1=O.
What is the InChIKey of 5-(1-hydroxy-2-methylpropyl)imidazolidine-2,4-dione?
The InChIKey is OXAFCFYZLFOZDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O3/c1-3(2)5(10)4-6(11)9-7(12)8-4/h3-5,10H,1-2H3,(H2,8,9,11,12).
What are the key properties of 5-(1-hydroxy-2-methylpropyl)imidazolidine-2,4-dione?
5-(1-hydroxy-2-methylpropyl)imidazolidine-2,4-dione has a molecular weight of 172.18 g/mol, XLogP of -0.79, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-hydroxy-2-methylpropyl)imidazolidine-2,4-dione is sourced from PubChem (CID 67857556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).