5,5-diphenyl-3-(3-piperidin-1-ylpropyl)imidazolidine-2,4-dione

C23H27N3O2 — CID 3041343

IUPAC5,5-diphenyl-3-(3-piperidin-1-ylpropyl)imidazolidine-2,4-dione
SMILESO=C1NC(c2ccccc2)(c2ccccc2)C(=O)N1CCCN1CCCCC1
InChIInChI=1S/C23H27N3O2/c27-21-23(19-11-4-1-5-12-19,20-13-6-2-7-14-20)24-22(28)26(21)18-10-17-25-15-8-3-9-16-25/h1-2,4-7,11-14H,3,8-10,15-18H2,(H,24,28)
InChIKeyONISVGVNTCDONI-UHFFFAOYSA-N
MW377.49 g/mol
LogP3.36
Rot. Bonds6

About 5,5-diphenyl-3-(3-piperidin-1-ylpropyl)imidazolidine-2,4-dione

5,5-diphenyl-3-(3-piperidin-1-ylpropyl)imidazolidine-2,4-dione (PubChem CID 3041343) has the molecular formula C23H27N3O2 and a molecular weight of 377.49 g/mol. Its IUPAC name is 5,5-diphenyl-3-(3-piperidin-1-ylpropyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name5,5-diphenyl-3-(3-piperidin-1-ylpropyl)imidazolidine-2,4-dione
PubChem CID3041343
Molecular FormulaC23H27N3O2
Molecular Weight377.49 g/mol
Exact Mass377.21
IUPAC Name5,5-diphenyl-3-(3-piperidin-1-ylpropyl)imidazolidine-2,4-dione
SMILESO=C1NC(c2ccccc2)(c2ccccc2)C(=O)N1CCCN1CCCCC1
InChIInChI=1S/C23H27N3O2/c27-21-23(19-11-4-1-5-12-19,20-13-6-2-7-14-20)24-22(28)26(21)18-10-17-25-15-8-3-9-16-25/h1-2,4-7,11-14H,3,8-10,15-18H2,(H,24,28)
InChIKeyONISVGVNTCDONI-UHFFFAOYSA-N
XLogP3.36
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.49
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

Phenytoin
CID 1775
Ethotoin
CID 3292
Mephenytoin
CID 4060
Phenytoin Sodium
CID 657302
Fosphenytoin
CID 56339
Fosphenytoin Sodium
CID 56338
Nirvanol
CID 91480
(5S)-5-methyl-5-phenylimidazolidine-2,4-dione
CID 640021
Mephenytoin, (+)-
CID 107921
Phenylhydantoin
CID 1002
5-Phenyl-5-propylimidazolidine-2,4-dione
CID 219572
(+)-Nirvanol
CID 6540813

Frequently Asked Questions

What is the IUPAC name of 5,5-diphenyl-3-(3-piperidin-1-ylpropyl)imidazolidine-2,4-dione?
The IUPAC name of 5,5-diphenyl-3-(3-piperidin-1-ylpropyl)imidazolidine-2,4-dione (CID 3041343) is 5,5-diphenyl-3-(3-piperidin-1-ylpropyl)imidazolidine-2,4-dione.
What is the SMILES notation for 5,5-diphenyl-3-(3-piperidin-1-ylpropyl)imidazolidine-2,4-dione?
The canonical SMILES for 5,5-diphenyl-3-(3-piperidin-1-ylpropyl)imidazolidine-2,4-dione is O=C1NC(c2ccccc2)(c2ccccc2)C(=O)N1CCCN1CCCCC1.
What is the InChIKey of 5,5-diphenyl-3-(3-piperidin-1-ylpropyl)imidazolidine-2,4-dione?
The InChIKey is ONISVGVNTCDONI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H27N3O2/c27-21-23(19-11-4-1-5-12-19,20-13-6-2-7-14-20)24-22(28)26(21)18-10-17-25-15-8-3-9-16-25/h1-2,4-7,11-14H,3,8-10,15-18H2,(H,24,28).
What are the key properties of 5,5-diphenyl-3-(3-piperidin-1-ylpropyl)imidazolidine-2,4-dione?
5,5-diphenyl-3-(3-piperidin-1-ylpropyl)imidazolidine-2,4-dione has a molecular weight of 377.49 g/mol, XLogP of 3.36, 6 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-piperidin-1-ylpropyl)imidazolidine-2,4-dione is sourced from PubChem (CID 3041343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).