3-[(3-hydroxy-2-methyloxolan-3-yl)methyl]imidazolidine-2,4-dione

C9H14N2O4 — CID 106103142

IUPAC3-[(3-hydroxy-2-methyloxolan-3-yl)methyl]imidazolidine-2,4-dione
SMILESCC1OCCC1(O)CN1C(=O)CNC1=O
InChIInChI=1S/C9H14N2O4/c1-6-9(14,2-3-15-6)5-11-7(12)4-10-8(11)13/h6,14H,2-5H2,1H3,(H,10,13)
InChIKeyGLJHCLZUDCPYEJ-UHFFFAOYSA-N
MW214.22 g/mol
LogP-0.92
Rot. Bonds2

About 3-[(3-hydroxy-2-methyloxolan-3-yl)methyl]imidazolidine-2,4-dione

3-[(3-hydroxy-2-methyloxolan-3-yl)methyl]imidazolidine-2,4-dione (PubChem CID 106103142) has the molecular formula C9H14N2O4 and a molecular weight of 214.22 g/mol. Its IUPAC name is 3-[(3-hydroxy-2-methyloxolan-3-yl)methyl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name3-[(3-hydroxy-2-methyloxolan-3-yl)methyl]imidazolidine-2,4-dione
PubChem CID106103142
Molecular FormulaC9H14N2O4
Molecular Weight214.22 g/mol
Exact Mass214.10
IUPAC Name3-[(3-hydroxy-2-methyloxolan-3-yl)methyl]imidazolidine-2,4-dione
SMILESCC1OCCC1(O)CN1C(=O)CNC1=O
InChIInChI=1S/C9H14N2O4/c1-6-9(14,2-3-15-6)5-11-7(12)4-10-8(11)13/h6,14H,2-5H2,1H3,(H,10,13)
InChIKeyGLJHCLZUDCPYEJ-UHFFFAOYSA-N
XLogP-0.92
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.22
LogP ≤ 5-0.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-[(3-hydroxy-2-methyloxolan-3-yl)methyl]thiomorpholine-3,5-dione
CID 106103089
3-[(3-hydroxy-2-methyloxolan-3-yl)methyl]-3-azabicyclo[3.2.1]octane-2,4-dione
CID 114143758
1-[(3-hydroxy-2-methyloxolan-3-yl)methyl]-2,6-dimethylpyridin-4-one
CID 106103103
3-[(1-methylcyclobutyl)methyl]imidazolidine-2,4-dione
CID 103936522
2-methyl-3-(7-oxa-2-azaspiro[3.5]nonan-2-ylmethyl)oxolan-3-ol
CID 106103086
2-methyl-3-pentyloxolan-3-ol
CID 82718337
3-(methoxymethyl)-2-methyloxolan-3-ol
CID 82719325
3-heptyl-2-methyloxolan-3-ol
CID 82718796
3-[(4-fluorophenyl)methyl]-2-methyloxolan-3-ol
CID 82717852
3-[(2,2,3,3-tetramethylcyclopropyl)methyl]imidazolidine-2,4-dione
CID 107842310
N-[(3-hydroxy-2-methyloxolan-3-yl)methyl]acetamide
CID 107302191
2-methyl-3-[[2-(1-methylimidazol-2-yl)ethylamino]methyl]oxolan-3-ol
CID 106101046

Frequently Asked Questions

What is the IUPAC name of 3-[(3-hydroxy-2-methyloxolan-3-yl)methyl]imidazolidine-2,4-dione?
The IUPAC name of 3-[(3-hydroxy-2-methyloxolan-3-yl)methyl]imidazolidine-2,4-dione (CID 106103142) is 3-[(3-hydroxy-2-methyloxolan-3-yl)methyl]imidazolidine-2,4-dione.
What is the SMILES notation for 3-[(3-hydroxy-2-methyloxolan-3-yl)methyl]imidazolidine-2,4-dione?
The canonical SMILES for 3-[(3-hydroxy-2-methyloxolan-3-yl)methyl]imidazolidine-2,4-dione is CC1OCCC1(O)CN1C(=O)CNC1=O.
What is the InChIKey of 3-[(3-hydroxy-2-methyloxolan-3-yl)methyl]imidazolidine-2,4-dione?
The InChIKey is GLJHCLZUDCPYEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O4/c1-6-9(14,2-3-15-6)5-11-7(12)4-10-8(11)13/h6,14H,2-5H2,1H3,(H,10,13).
What are the key properties of 3-[(3-hydroxy-2-methyloxolan-3-yl)methyl]imidazolidine-2,4-dione?
3-[(3-hydroxy-2-methyloxolan-3-yl)methyl]imidazolidine-2,4-dione has a molecular weight of 214.22 g/mol, XLogP of -0.92, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3-hydroxy-2-methyloxolan-3-yl)methyl]imidazolidine-2,4-dione is sourced from PubChem (CID 106103142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).