5-hydroxy-1-(4-methylphenyl)-3-(2-oxo-1,3-diphenyl-1,3,2λ5-diazaphospholidin-2-yl)pyrrolidin-2-one

C25H26N3O3P — CID 134274772

IUPAC5-hydroxy-1-(4-methylphenyl)-3-(2-oxo-1,3-diphenyl-1,3,2λ5-diazaphospholidin-2-yl)pyrrolidin-2-one
SMILESCc1ccc(N2C(=O)C(P3(=O)N(c4ccccc4)CCN3c3ccccc3)CC2O)cc1
InChIInChI=1S/C25H26N3O3P/c1-19-12-14-22(15-13-19)28-24(29)18-23(25(28)30)32(31)26(20-8-4-2-5-9-20)16-17-27(32)21-10-6-3-7-11-21/h2-15,23-24,29H,16-18H2,1H3
InChIKeyWDDMLWWFDCFJNA-UHFFFAOYSA-N
MW447.48 g/mol
LogP4.64
Rot. Bonds4

About 5-hydroxy-1-(4-methylphenyl)-3-(2-oxo-1,3-diphenyl-1,3,2λ5-diazaphospholidin-2-yl)pyrrolidin-2-one

5-hydroxy-1-(4-methylphenyl)-3-(2-oxo-1,3-diphenyl-1,3,2λ5-diazaphospholidin-2-yl)pyrrolidin-2-one (PubChem CID 134274772) has the molecular formula C25H26N3O3P and a molecular weight of 447.48 g/mol. Its IUPAC name is 5-hydroxy-1-(4-methylphenyl)-3-(2-oxo-1,3-diphenyl-1,3,2λ5-diazaphospholidin-2-yl)pyrrolidin-2-one.

Molecular Properties

Compound Name5-hydroxy-1-(4-methylphenyl)-3-(2-oxo-1,3-diphenyl-1,3,2λ5-diazaphospholidin-2-yl)pyrrolidin-2-one
PubChem CID134274772
Molecular FormulaC25H26N3O3P
Molecular Weight447.48 g/mol
Exact Mass447.17
IUPAC Name5-hydroxy-1-(4-methylphenyl)-3-(2-oxo-1,3-diphenyl-1,3,2λ5-diazaphospholidin-2-yl)pyrrolidin-2-one
SMILESCc1ccc(N2C(=O)C(P3(=O)N(c4ccccc4)CCN3c3ccccc3)CC2O)cc1
InChIInChI=1S/C25H26N3O3P/c1-19-12-14-22(15-13-19)28-24(29)18-23(25(28)30)32(31)26(20-8-4-2-5-9-20)16-17-27(32)21-10-6-3-7-11-21/h2-15,23-24,29H,16-18H2,1H3
InChIKeyWDDMLWWFDCFJNA-UHFFFAOYSA-N
XLogP4.64
TPSA64.09 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500447.48
LogP ≤ 54.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 5-hydroxy-1-(4-methylphenyl)-3-(2-oxo-1,3-diphenyl-1,3,2λ5-diazaphospholidin-2-yl)pyrrolidin-2-one 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-hydroxy-1-(4-methylphenyl)-3-(2-oxo-1,3-diphenyl-1,3,2λ5-diazaphospholidin-2-yl)pyrrolidin-2-one?
The IUPAC name of 5-hydroxy-1-(4-methylphenyl)-3-(2-oxo-1,3-diphenyl-1,3,2λ5-diazaphospholidin-2-yl)pyrrolidin-2-one (CID 134274772) is 5-hydroxy-1-(4-methylphenyl)-3-(2-oxo-1,3-diphenyl-1,3,2λ5-diazaphospholidin-2-yl)pyrrolidin-2-one.
What is the SMILES notation for 5-hydroxy-1-(4-methylphenyl)-3-(2-oxo-1,3-diphenyl-1,3,2λ5-diazaphospholidin-2-yl)pyrrolidin-2-one?
The canonical SMILES for 5-hydroxy-1-(4-methylphenyl)-3-(2-oxo-1,3-diphenyl-1,3,2λ5-diazaphospholidin-2-yl)pyrrolidin-2-one is Cc1ccc(N2C(=O)C(P3(=O)N(c4ccccc4)CCN3c3ccccc3)CC2O)cc1.
What is the InChIKey of 5-hydroxy-1-(4-methylphenyl)-3-(2-oxo-1,3-diphenyl-1,3,2λ5-diazaphospholidin-2-yl)pyrrolidin-2-one?
The InChIKey is WDDMLWWFDCFJNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N3O3P/c1-19-12-14-22(15-13-19)28-24(29)18-23(25(28)30)32(31)26(20-8-4-2-5-9-20)16-17-27(32)21-10-6-3-7-11-21/h2-15,23-24,29H,16-18H2,1H3.
What are the key properties of 5-hydroxy-1-(4-methylphenyl)-3-(2-oxo-1,3-diphenyl-1,3,2λ5-diazaphospholidin-2-yl)pyrrolidin-2-one?
5-hydroxy-1-(4-methylphenyl)-3-(2-oxo-1,3-diphenyl-1,3,2λ5-diazaphospholidin-2-yl)pyrrolidin-2-one has a molecular weight of 447.48 g/mol, XLogP of 4.64, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-1-(4-methylphenyl)-3-(2-oxo-1,3-diphenyl-1,3,2λ5-diazaphospholidin-2-yl)pyrrolidin-2-one is sourced from PubChem (CID 134274772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).