3-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-5,5-diphenylimidazolidine-2,4-dione

C23H25N3O3 — CID 5190925

IUPAC3-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-5,5-diphenylimidazolidine-2,4-dione
SMILESCC1CCN(C(=O)CN2C(=O)NC(c3ccccc3)(c3ccccc3)C2=O)CC1
InChIInChI=1S/C23H25N3O3/c1-17-12-14-25(15-13-17)20(27)16-26-21(28)23(24-22(26)29,18-8-4-2-5-9-18)19-10-6-3-7-11-19/h2-11,17H,12-16H2,1H3,(H,24,29)
InChIKeyKYKNHRCGKHREJL-UHFFFAOYSA-N
MW391.47 g/mol
LogP2.74
Rot. Bonds4

About 3-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-5,5-diphenylimidazolidine-2,4-dione

3-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-5,5-diphenylimidazolidine-2,4-dione (PubChem CID 5190925) has the molecular formula C23H25N3O3 and a molecular weight of 391.47 g/mol. Its IUPAC name is 3-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-5,5-diphenylimidazolidine-2,4-dione.

Molecular Properties

Compound Name3-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-5,5-diphenylimidazolidine-2,4-dione
PubChem CID5190925
Molecular FormulaC23H25N3O3
Molecular Weight391.47 g/mol
Exact Mass391.19
IUPAC Name3-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-5,5-diphenylimidazolidine-2,4-dione
SMILESCC1CCN(C(=O)CN2C(=O)NC(c3ccccc3)(c3ccccc3)C2=O)CC1
InChIInChI=1S/C23H25N3O3/c1-17-12-14-25(15-13-17)20(27)16-26-21(28)23(24-22(26)29,18-8-4-2-5-9-18)19-10-6-3-7-11-19/h2-11,17H,12-16H2,1H3,(H,24,29)
InChIKeyKYKNHRCGKHREJL-UHFFFAOYSA-N
XLogP2.74
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.47
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 3-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-5,5-diphenylimidazolidine-2,4-dione 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-(4-methylpiperidin-1-yl)-2-oxoethyl]-5,5-diphenylimidazolidine-2,4-dione?
The IUPAC name of 3-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-5,5-diphenylimidazolidine-2,4-dione (CID 5190925) is 3-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-5,5-diphenylimidazolidine-2,4-dione.
What is the SMILES notation for 3-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-5,5-diphenylimidazolidine-2,4-dione?
The canonical SMILES for 3-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-5,5-diphenylimidazolidine-2,4-dione is CC1CCN(C(=O)CN2C(=O)NC(c3ccccc3)(c3ccccc3)C2=O)CC1.
What is the InChIKey of 3-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-5,5-diphenylimidazolidine-2,4-dione?
The InChIKey is KYKNHRCGKHREJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O3/c1-17-12-14-25(15-13-17)20(27)16-26-21(28)23(24-22(26)29,18-8-4-2-5-9-18)19-10-6-3-7-11-19/h2-11,17H,12-16H2,1H3,(H,24,29).
What are the key properties of 3-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-5,5-diphenylimidazolidine-2,4-dione?
3-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-5,5-diphenylimidazolidine-2,4-dione has a molecular weight of 391.47 g/mol, XLogP of 2.74, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-5,5-diphenylimidazolidine-2,4-dione is sourced from PubChem (CID 5190925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).