5-[[4-(hydroxymethyl)phenyl]methyl]imidazolidine-2,4-dione

C11H12N2O3 — CID 69297973

IUPAC5-[[4-(hydroxymethyl)phenyl]methyl]imidazolidine-2,4-dione
SMILESO=C1NC(=O)C(Cc2ccc(CO)cc2)N1
InChIInChI=1S/C11H12N2O3/c14-6-8-3-1-7(2-4-8)5-9-10(15)13-11(16)12-9/h1-4,9,14H,5-6H2,(H2,12,13,15,16)
InChIKeyDQWHCZYENMPXJO-UHFFFAOYSA-N
MW220.23 g/mol
LogP-0.07
Rot. Bonds3

About 5-[[4-(hydroxymethyl)phenyl]methyl]imidazolidine-2,4-dione

5-[[4-(hydroxymethyl)phenyl]methyl]imidazolidine-2,4-dione (PubChem CID 69297973) has the molecular formula C11H12N2O3 and a molecular weight of 220.23 g/mol. Its IUPAC name is 5-[[4-(hydroxymethyl)phenyl]methyl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name5-[[4-(hydroxymethyl)phenyl]methyl]imidazolidine-2,4-dione
PubChem CID69297973
Molecular FormulaC11H12N2O3
Molecular Weight220.23 g/mol
Exact Mass220.08
IUPAC Name5-[[4-(hydroxymethyl)phenyl]methyl]imidazolidine-2,4-dione
SMILESO=C1NC(=O)C(Cc2ccc(CO)cc2)N1
InChIInChI=1S/C11H12N2O3/c14-6-8-3-1-7(2-4-8)5-9-10(15)13-11(16)12-9/h1-4,9,14H,5-6H2,(H2,12,13,15,16)
InChIKeyDQWHCZYENMPXJO-UHFFFAOYSA-N
XLogP-0.07
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.23
LogP ≤ 5-0.07
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-[[4-(hydroxymethyl)phenyl]methyl]imidazolidine-2,4-dione?
The IUPAC name of 5-[[4-(hydroxymethyl)phenyl]methyl]imidazolidine-2,4-dione (CID 69297973) is 5-[[4-(hydroxymethyl)phenyl]methyl]imidazolidine-2,4-dione.
What is the SMILES notation for 5-[[4-(hydroxymethyl)phenyl]methyl]imidazolidine-2,4-dione?
The canonical SMILES for 5-[[4-(hydroxymethyl)phenyl]methyl]imidazolidine-2,4-dione is O=C1NC(=O)C(Cc2ccc(CO)cc2)N1.
What is the InChIKey of 5-[[4-(hydroxymethyl)phenyl]methyl]imidazolidine-2,4-dione?
The InChIKey is DQWHCZYENMPXJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O3/c14-6-8-3-1-7(2-4-8)5-9-10(15)13-11(16)12-9/h1-4,9,14H,5-6H2,(H2,12,13,15,16).
What are the key properties of 5-[[4-(hydroxymethyl)phenyl]methyl]imidazolidine-2,4-dione?
5-[[4-(hydroxymethyl)phenyl]methyl]imidazolidine-2,4-dione has a molecular weight of 220.23 g/mol, XLogP of -0.07, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[4-(hydroxymethyl)phenyl]methyl]imidazolidine-2,4-dione is sourced from PubChem (CID 69297973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).