3-(2-hydroxyethyl)-1-methylimidazolidine-2,4-dione

C6H10N2O3 — CID 43393686

IUPAC3-(2-hydroxyethyl)-1-methylimidazolidine-2,4-dione
SMILESCN1CC(=O)N(CCO)C1=O
InChIInChI=1S/C6H10N2O3/c1-7-4-5(10)8(2-3-9)6(7)11/h9H,2-4H2,1H3
InChIKeyBNDPVURFRKZNNP-UHFFFAOYSA-N
MW158.16 g/mol
LogP-1.13
Rot. Bonds2

About 3-(2-hydroxyethyl)-1-methylimidazolidine-2,4-dione

3-(2-hydroxyethyl)-1-methylimidazolidine-2,4-dione (PubChem CID 43393686) has the molecular formula C6H10N2O3 and a molecular weight of 158.16 g/mol. Its IUPAC name is 3-(2-hydroxyethyl)-1-methylimidazolidine-2,4-dione.

Molecular Properties

Compound Name3-(2-hydroxyethyl)-1-methylimidazolidine-2,4-dione
PubChem CID43393686
Molecular FormulaC6H10N2O3
Molecular Weight158.16 g/mol
Exact Mass158.07
IUPAC Name3-(2-hydroxyethyl)-1-methylimidazolidine-2,4-dione
SMILESCN1CC(=O)N(CCO)C1=O
InChIInChI=1S/C6H10N2O3/c1-7-4-5(10)8(2-3-9)6(7)11/h9H,2-4H2,1H3
InChIKeyBNDPVURFRKZNNP-UHFFFAOYSA-N
XLogP-1.13
TPSA60.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.16
LogP ≤ 5-1.13
H-Bond Donors ≤ 51
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 3-(2-hydroxyethyl)-1-methylimidazolidine-2,4-dione?
The IUPAC name of 3-(2-hydroxyethyl)-1-methylimidazolidine-2,4-dione (CID 43393686) is 3-(2-hydroxyethyl)-1-methylimidazolidine-2,4-dione.
What is the SMILES notation for 3-(2-hydroxyethyl)-1-methylimidazolidine-2,4-dione?
The canonical SMILES for 3-(2-hydroxyethyl)-1-methylimidazolidine-2,4-dione is CN1CC(=O)N(CCO)C1=O.
What is the InChIKey of 3-(2-hydroxyethyl)-1-methylimidazolidine-2,4-dione?
The InChIKey is BNDPVURFRKZNNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O3/c1-7-4-5(10)8(2-3-9)6(7)11/h9H,2-4H2,1H3.
What are the key properties of 3-(2-hydroxyethyl)-1-methylimidazolidine-2,4-dione?
3-(2-hydroxyethyl)-1-methylimidazolidine-2,4-dione has a molecular weight of 158.16 g/mol, XLogP of -1.13, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-hydroxyethyl)-1-methylimidazolidine-2,4-dione is sourced from PubChem (CID 43393686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).