3-(2-methoxy-2-methylpropyl)-5-phenylimidazolidin-4-one

C14H20N2O2 — CID 113451090

IUPAC3-(2-methoxy-2-methylpropyl)-5-phenylimidazolidin-4-one
SMILESCOC(C)(C)CN1CNC(c2ccccc2)C1=O
InChIInChI=1S/C14H20N2O2/c1-14(2,18-3)9-16-10-15-12(13(16)17)11-7-5-4-6-8-11/h4-8,12,15H,9-10H2,1-3H3
InChIKeyJQESGEVPPVSVDQ-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.54
Rot. Bonds4

About 3-(2-methoxy-2-methylpropyl)-5-phenylimidazolidin-4-one

3-(2-methoxy-2-methylpropyl)-5-phenylimidazolidin-4-one (PubChem CID 113451090) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is 3-(2-methoxy-2-methylpropyl)-5-phenylimidazolidin-4-one.

Molecular Properties

Compound Name3-(2-methoxy-2-methylpropyl)-5-phenylimidazolidin-4-one
PubChem CID113451090
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC Name3-(2-methoxy-2-methylpropyl)-5-phenylimidazolidin-4-one
SMILESCOC(C)(C)CN1CNC(c2ccccc2)C1=O
InChIInChI=1S/C14H20N2O2/c1-14(2,18-3)9-16-10-15-12(13(16)17)11-7-5-4-6-8-11/h4-8,12,15H,9-10H2,1-3H3
InChIKeyJQESGEVPPVSVDQ-UHFFFAOYSA-N
XLogP1.54
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-(2-methoxy-2-methylpropyl)-5-phenylimidazolidin-4-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 3-(2-methoxy-2-methylpropyl)-5-phenylimidazolidin-4-one?
The IUPAC name of 3-(2-methoxy-2-methylpropyl)-5-phenylimidazolidin-4-one (CID 113451090) is 3-(2-methoxy-2-methylpropyl)-5-phenylimidazolidin-4-one.
What is the SMILES notation for 3-(2-methoxy-2-methylpropyl)-5-phenylimidazolidin-4-one?
The canonical SMILES for 3-(2-methoxy-2-methylpropyl)-5-phenylimidazolidin-4-one is COC(C)(C)CN1CNC(c2ccccc2)C1=O.
What is the InChIKey of 3-(2-methoxy-2-methylpropyl)-5-phenylimidazolidin-4-one?
The InChIKey is JQESGEVPPVSVDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-14(2,18-3)9-16-10-15-12(13(16)17)11-7-5-4-6-8-11/h4-8,12,15H,9-10H2,1-3H3.
What are the key properties of 3-(2-methoxy-2-methylpropyl)-5-phenylimidazolidin-4-one?
3-(2-methoxy-2-methylpropyl)-5-phenylimidazolidin-4-one has a molecular weight of 248.33 g/mol, XLogP of 1.54, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxy-2-methylpropyl)-5-phenylimidazolidin-4-one is sourced from PubChem (CID 113451090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).