5-phenyl-3-[3-(4-phenylpiperidin-1-yl)propyl]-5-pyridin-4-ylimidazolidine-2,4-dione

C28H30N4O2 — CID 21395250

IUPAC5-phenyl-3-[3-(4-phenylpiperidin-1-yl)propyl]-5-pyridin-4-ylimidazolidine-2,4-dione
SMILESO=C1NC(c2ccccc2)(c2ccncc2)C(=O)N1CCCN1CCC(c2ccccc2)CC1
InChIInChI=1S/C28H30N4O2/c33-26-28(24-10-5-2-6-11-24,25-12-16-29-17-13-25)30-27(34)32(26)19-7-18-31-20-14-23(15-21-31)22-8-3-1-4-9-22/h1-6,8-13,16-17,23H,7,14-15,18-21H2,(H,30,34)
InChIKeyRCYLZMNKASDGTJ-UHFFFAOYSA-N
MW454.57 g/mol
LogP4.15
Rot. Bonds7

About 5-phenyl-3-[3-(4-phenylpiperidin-1-yl)propyl]-5-pyridin-4-ylimidazolidine-2,4-dione

5-phenyl-3-[3-(4-phenylpiperidin-1-yl)propyl]-5-pyridin-4-ylimidazolidine-2,4-dione (PubChem CID 21395250) has the molecular formula C28H30N4O2 and a molecular weight of 454.57 g/mol. Its IUPAC name is 5-phenyl-3-[3-(4-phenylpiperidin-1-yl)propyl]-5-pyridin-4-ylimidazolidine-2,4-dione.

Molecular Properties

Compound Name5-phenyl-3-[3-(4-phenylpiperidin-1-yl)propyl]-5-pyridin-4-ylimidazolidine-2,4-dione
PubChem CID21395250
Molecular FormulaC28H30N4O2
Molecular Weight454.57 g/mol
Exact Mass454.24
IUPAC Name5-phenyl-3-[3-(4-phenylpiperidin-1-yl)propyl]-5-pyridin-4-ylimidazolidine-2,4-dione
SMILESO=C1NC(c2ccccc2)(c2ccncc2)C(=O)N1CCCN1CCC(c2ccccc2)CC1
InChIInChI=1S/C28H30N4O2/c33-26-28(24-10-5-2-6-11-24,25-12-16-29-17-13-25)30-27(34)32(26)19-7-18-31-20-14-23(15-21-31)22-8-3-1-4-9-22/h1-6,8-13,16-17,23H,7,14-15,18-21H2,(H,30,34)
InChIKeyRCYLZMNKASDGTJ-UHFFFAOYSA-N
XLogP4.15
TPSA65.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500454.57
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

5,5-diphenyl-3-[2-(4-phenylpiperidin-1-yl)ethyl]imidazolidine-2,4-dione
CID 21481466
5-(4-bromophenyl)-5-phenyl-3-[3-(4-phenylpiperidin-1-yl)propyl]imidazolidine-2,4-dione;hydrochloride
CID 3043731
but-2-enedioic acid;5-phenyl-3-[3-(4-phenylpiperidin-1-yl)propyl]-5-pyridin-3-ylimidazolidine-2,4-dione
CID 70634417
3-[3-(4-isocyano-4-phenylpiperidin-1-yl)propyl]-5,5-diphenylimidazolidine-2,4-dione
CID 22960997
1-[3-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)propyl]-4-phenylpiperidine-4-carbonitrile
CID 10299367
5,5-dimethyl-3-[2-(4-phenylpiperidin-1-yl)ethyl]imidazolidine-2,4-dione
CID 56811818
5,5-diphenyl-3-[(4-pyridin-4-ylpiperazin-1-yl)methyl]imidazolidine-2,4-dione
CID 31384492
5,5-diphenyl-3-(3-sulfanylpropyl)imidazolidine-2,4-dione
CID 102066490
N-[4-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)butyl]-2-pyridin-4-ylacetamide
CID 70826266
3-decyl-5,5-diphenylimidazolidine-2,4-dione
CID 11696827
3-hexyl-5,5-diphenylimidazolidine-2,4-dione
CID 24860362
5,5-diphenyl-3-[[(2R)-2-pyridin-3-ylpyrrolidin-1-yl]methyl]imidazolidine-2,4-dione
CID 35947653

Frequently Asked Questions

What is the IUPAC name of 5-phenyl-3-[3-(4-phenylpiperidin-1-yl)propyl]-5-pyridin-4-ylimidazolidine-2,4-dione?
The IUPAC name of 5-phenyl-3-[3-(4-phenylpiperidin-1-yl)propyl]-5-pyridin-4-ylimidazolidine-2,4-dione (CID 21395250) is 5-phenyl-3-[3-(4-phenylpiperidin-1-yl)propyl]-5-pyridin-4-ylimidazolidine-2,4-dione.
What is the SMILES notation for 5-phenyl-3-[3-(4-phenylpiperidin-1-yl)propyl]-5-pyridin-4-ylimidazolidine-2,4-dione?
The canonical SMILES for 5-phenyl-3-[3-(4-phenylpiperidin-1-yl)propyl]-5-pyridin-4-ylimidazolidine-2,4-dione is O=C1NC(c2ccccc2)(c2ccncc2)C(=O)N1CCCN1CCC(c2ccccc2)CC1.
What is the InChIKey of 5-phenyl-3-[3-(4-phenylpiperidin-1-yl)propyl]-5-pyridin-4-ylimidazolidine-2,4-dione?
The InChIKey is RCYLZMNKASDGTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H30N4O2/c33-26-28(24-10-5-2-6-11-24,25-12-16-29-17-13-25)30-27(34)32(26)19-7-18-31-20-14-23(15-21-31)22-8-3-1-4-9-22/h1-6,8-13,16-17,23H,7,14-15,18-21H2,(H,30,34).
What are the key properties of 5-phenyl-3-[3-(4-phenylpiperidin-1-yl)propyl]-5-pyridin-4-ylimidazolidine-2,4-dione?
5-phenyl-3-[3-(4-phenylpiperidin-1-yl)propyl]-5-pyridin-4-ylimidazolidine-2,4-dione has a molecular weight of 454.57 g/mol, XLogP of 4.15, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenyl-3-[3-(4-phenylpiperidin-1-yl)propyl]-5-pyridin-4-ylimidazolidine-2,4-dione is sourced from PubChem (CID 21395250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).