1-benzyl-3-hydroxyimidazol-2-one

C10H10N2O2 — CID 44541206

IUPAC1-benzyl-3-hydroxyimidazol-2-one
SMILESO=c1n(O)ccn1Cc1ccccc1
InChIInChI=1S/C10H10N2O2/c13-10-11(6-7-12(10)14)8-9-4-2-1-3-5-9/h1-7,14H,8H2
InChIKeyKEOZDNMCRGLMHT-UHFFFAOYSA-N
MW190.20 g/mol
LogP0.94
Rot. Bonds2

About 1-benzyl-3-hydroxyimidazol-2-one

1-benzyl-3-hydroxyimidazol-2-one (PubChem CID 44541206) has the molecular formula C10H10N2O2 and a molecular weight of 190.20 g/mol. Its IUPAC name is 1-benzyl-3-hydroxyimidazol-2-one.

Molecular Properties

Compound Name1-benzyl-3-hydroxyimidazol-2-one
PubChem CID44541206
Molecular FormulaC10H10N2O2
Molecular Weight190.20 g/mol
Exact Mass190.07
IUPAC Name1-benzyl-3-hydroxyimidazol-2-one
SMILESO=c1n(O)ccn1Cc1ccccc1
InChIInChI=1S/C10H10N2O2/c13-10-11(6-7-12(10)14)8-9-4-2-1-3-5-9/h1-7,14H,8H2
InChIKeyKEOZDNMCRGLMHT-UHFFFAOYSA-N
XLogP0.94
TPSA47.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.20
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 1-benzyl-3-hydroxyimidazol-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-3-hydroxyimidazol-2-one?
The IUPAC name of 1-benzyl-3-hydroxyimidazol-2-one (CID 44541206) is 1-benzyl-3-hydroxyimidazol-2-one.
What is the SMILES notation for 1-benzyl-3-hydroxyimidazol-2-one?
The canonical SMILES for 1-benzyl-3-hydroxyimidazol-2-one is O=c1n(O)ccn1Cc1ccccc1.
What is the InChIKey of 1-benzyl-3-hydroxyimidazol-2-one?
The InChIKey is KEOZDNMCRGLMHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O2/c13-10-11(6-7-12(10)14)8-9-4-2-1-3-5-9/h1-7,14H,8H2.
What are the key properties of 1-benzyl-3-hydroxyimidazol-2-one?
1-benzyl-3-hydroxyimidazol-2-one has a molecular weight of 190.20 g/mol, XLogP of 0.94, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-3-hydroxyimidazol-2-one is sourced from PubChem (CID 44541206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).