1,3-bis(methoxymethyl)imidazolidine-2,4-dione

C7H12N2O4 — CID 10219738

IUPAC1,3-bis(methoxymethyl)imidazolidine-2,4-dione
SMILESCOCN1CC(=O)N(COC)C1=O
InChIInChI=1S/C7H12N2O4/c1-12-4-8-3-6(10)9(5-13-2)7(8)11/h3-5H2,1-2H3
InChIKeySYZHATLSADKZJD-UHFFFAOYSA-N
MW188.18 g/mol
LogP-0.54
Rot. Bonds4

About 1,3-bis(methoxymethyl)imidazolidine-2,4-dione

1,3-bis(methoxymethyl)imidazolidine-2,4-dione (PubChem CID 10219738) has the molecular formula C7H12N2O4 and a molecular weight of 188.18 g/mol. Its IUPAC name is 1,3-bis(methoxymethyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name1,3-bis(methoxymethyl)imidazolidine-2,4-dione
PubChem CID10219738
Molecular FormulaC7H12N2O4
Molecular Weight188.18 g/mol
Exact Mass188.08
IUPAC Name1,3-bis(methoxymethyl)imidazolidine-2,4-dione
SMILESCOCN1CC(=O)N(COC)C1=O
InChIInChI=1S/C7H12N2O4/c1-12-4-8-3-6(10)9(5-13-2)7(8)11/h3-5H2,1-2H3
InChIKeySYZHATLSADKZJD-UHFFFAOYSA-N
XLogP-0.54
TPSA59.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.18
LogP ≤ 5-0.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,3-bis(methoxymethyl)imidazolidine-2,4-dione?
The IUPAC name of 1,3-bis(methoxymethyl)imidazolidine-2,4-dione (CID 10219738) is 1,3-bis(methoxymethyl)imidazolidine-2,4-dione.
What is the SMILES notation for 1,3-bis(methoxymethyl)imidazolidine-2,4-dione?
The canonical SMILES for 1,3-bis(methoxymethyl)imidazolidine-2,4-dione is COCN1CC(=O)N(COC)C1=O.
What is the InChIKey of 1,3-bis(methoxymethyl)imidazolidine-2,4-dione?
The InChIKey is SYZHATLSADKZJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O4/c1-12-4-8-3-6(10)9(5-13-2)7(8)11/h3-5H2,1-2H3.
What are the key properties of 1,3-bis(methoxymethyl)imidazolidine-2,4-dione?
1,3-bis(methoxymethyl)imidazolidine-2,4-dione has a molecular weight of 188.18 g/mol, XLogP of -0.54, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-bis(methoxymethyl)imidazolidine-2,4-dione is sourced from PubChem (CID 10219738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).