5,5-diphenyl-3-[3-(4-phenylpiperidin-1-yl)propyl]imidazolidine-2,4-dione

C29H31N3O2 — CID 3043720

IUPAC5,5-diphenyl-3-[3-(4-phenylpiperidin-1-yl)propyl]imidazolidine-2,4-dione
SMILESO=C1NC(c2ccccc2)(c2ccccc2)C(=O)N1CCCN1CCC(c2ccccc2)CC1
InChIInChI=1S/C29H31N3O2/c33-27-29(25-13-6-2-7-14-25,26-15-8-3-9-16-26)30-28(34)32(27)20-10-19-31-21-17-24(18-22-31)23-11-4-1-5-12-23/h1-9,11-16,24H,10,17-22H2,(H,30,34)
InChIKeyYOOUNLNKTHKXOV-UHFFFAOYSA-N
MW453.59 g/mol
LogP4.75
Rot. Bonds7

About 5,5-diphenyl-3-[3-(4-phenylpiperidin-1-yl)propyl]imidazolidine-2,4-dione

5,5-diphenyl-3-[3-(4-phenylpiperidin-1-yl)propyl]imidazolidine-2,4-dione (PubChem CID 3043720) has the molecular formula C29H31N3O2 and a molecular weight of 453.59 g/mol. Its IUPAC name is 5,5-diphenyl-3-[3-(4-phenylpiperidin-1-yl)propyl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name5,5-diphenyl-3-[3-(4-phenylpiperidin-1-yl)propyl]imidazolidine-2,4-dione
PubChem CID3043720
Molecular FormulaC29H31N3O2
Molecular Weight453.59 g/mol
Exact Mass453.24
IUPAC Name5,5-diphenyl-3-[3-(4-phenylpiperidin-1-yl)propyl]imidazolidine-2,4-dione
SMILESO=C1NC(c2ccccc2)(c2ccccc2)C(=O)N1CCCN1CCC(c2ccccc2)CC1
InChIInChI=1S/C29H31N3O2/c33-27-29(25-13-6-2-7-14-25,26-15-8-3-9-16-26)30-28(34)32(27)20-10-19-31-21-17-24(18-22-31)23-11-4-1-5-12-23/h1-9,11-16,24H,10,17-22H2,(H,30,34)
InChIKeyYOOUNLNKTHKXOV-UHFFFAOYSA-N
XLogP4.75
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500453.59
LogP ≤ 54.75
H-Bond Donors ≤ 51
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 5,5-diphenyl-3-[3-(4-phenylpiperidin-1-yl)propyl]imidazolidine-2,4-dione?
The IUPAC name of 5,5-diphenyl-3-[3-(4-phenylpiperidin-1-yl)propyl]imidazolidine-2,4-dione (CID 3043720) is 5,5-diphenyl-3-[3-(4-phenylpiperidin-1-yl)propyl]imidazolidine-2,4-dione.
What is the SMILES notation for 5,5-diphenyl-3-[3-(4-phenylpiperidin-1-yl)propyl]imidazolidine-2,4-dione?
The canonical SMILES for 5,5-diphenyl-3-[3-(4-phenylpiperidin-1-yl)propyl]imidazolidine-2,4-dione is O=C1NC(c2ccccc2)(c2ccccc2)C(=O)N1CCCN1CCC(c2ccccc2)CC1.
What is the InChIKey of 5,5-diphenyl-3-[3-(4-phenylpiperidin-1-yl)propyl]imidazolidine-2,4-dione?
The InChIKey is YOOUNLNKTHKXOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H31N3O2/c33-27-29(25-13-6-2-7-14-25,26-15-8-3-9-16-26)30-28(34)32(27)20-10-19-31-21-17-24(18-22-31)23-11-4-1-5-12-23/h1-9,11-16,24H,10,17-22H2,(H,30,34).
What are the key properties of 5,5-diphenyl-3-[3-(4-phenylpiperidin-1-yl)propyl]imidazolidine-2,4-dione?
5,5-diphenyl-3-[3-(4-phenylpiperidin-1-yl)propyl]imidazolidine-2,4-dione has a molecular weight of 453.59 g/mol, XLogP of 4.75, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-diphenyl-3-[3-(4-phenylpiperidin-1-yl)propyl]imidazolidine-2,4-dione is sourced from PubChem (CID 3043720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).