5-[2-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-2-oxoethyl]-3-(2-phenylethyl)imidazolidine-2,4-dione

C24H26ClN3O4 — CID 71701821

IUPAC5-[2-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-2-oxoethyl]-3-(2-phenylethyl)imidazolidine-2,4-dione
SMILESO=C(CC1NC(=O)N(CCc2ccccc2)C1=O)N1CCC(O)(c2ccc(Cl)cc2)CC1
InChIInChI=1S/C24H26ClN3O4/c25-19-8-6-18(7-9-19)24(32)11-14-27(15-12-24)21(29)16-20-22(30)28(23(31)26-20)13-10-17-4-2-1-3-5-17/h1-9,20,32H,10-16H2,(H,26,31)
InChIKeySYPDMPCHUNTXCU-UHFFFAOYSA-N
MW455.94 g/mol
LogP2.70
Rot. Bonds6

About 5-[2-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-2-oxoethyl]-3-(2-phenylethyl)imidazolidine-2,4-dione

5-[2-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-2-oxoethyl]-3-(2-phenylethyl)imidazolidine-2,4-dione (PubChem CID 71701821) has the molecular formula C24H26ClN3O4 and a molecular weight of 455.94 g/mol. Its IUPAC name is 5-[2-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-2-oxoethyl]-3-(2-phenylethyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name5-[2-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-2-oxoethyl]-3-(2-phenylethyl)imidazolidine-2,4-dione
PubChem CID71701821
Molecular FormulaC24H26ClN3O4
Molecular Weight455.94 g/mol
Exact Mass455.16
IUPAC Name5-[2-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-2-oxoethyl]-3-(2-phenylethyl)imidazolidine-2,4-dione
SMILESO=C(CC1NC(=O)N(CCc2ccccc2)C1=O)N1CCC(O)(c2ccc(Cl)cc2)CC1
InChIInChI=1S/C24H26ClN3O4/c25-19-8-6-18(7-9-19)24(32)11-14-27(15-12-24)21(29)16-20-22(30)28(23(31)26-20)13-10-17-4-2-1-3-5-17/h1-9,20,32H,10-16H2,(H,26,31)
InChIKeySYPDMPCHUNTXCU-UHFFFAOYSA-N
XLogP2.70
TPSA89.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500455.94
LogP ≤ 52.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 5-[2-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-2-oxoethyl]-3-(2-phenylethyl)imidazolidine-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 5-[2-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-2-oxoethyl]-3-(2-phenylethyl)imidazolidine-2,4-dione?
The IUPAC name of 5-[2-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-2-oxoethyl]-3-(2-phenylethyl)imidazolidine-2,4-dione (CID 71701821) is 5-[2-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-2-oxoethyl]-3-(2-phenylethyl)imidazolidine-2,4-dione.
What is the SMILES notation for 5-[2-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-2-oxoethyl]-3-(2-phenylethyl)imidazolidine-2,4-dione?
The canonical SMILES for 5-[2-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-2-oxoethyl]-3-(2-phenylethyl)imidazolidine-2,4-dione is O=C(CC1NC(=O)N(CCc2ccccc2)C1=O)N1CCC(O)(c2ccc(Cl)cc2)CC1.
What is the InChIKey of 5-[2-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-2-oxoethyl]-3-(2-phenylethyl)imidazolidine-2,4-dione?
The InChIKey is SYPDMPCHUNTXCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26ClN3O4/c25-19-8-6-18(7-9-19)24(32)11-14-27(15-12-24)21(29)16-20-22(30)28(23(31)26-20)13-10-17-4-2-1-3-5-17/h1-9,20,32H,10-16H2,(H,26,31).
What are the key properties of 5-[2-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-2-oxoethyl]-3-(2-phenylethyl)imidazolidine-2,4-dione?
5-[2-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-2-oxoethyl]-3-(2-phenylethyl)imidazolidine-2,4-dione has a molecular weight of 455.94 g/mol, XLogP of 2.70, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-2-oxoethyl]-3-(2-phenylethyl)imidazolidine-2,4-dione is sourced from PubChem (CID 71701821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).