4-hydroxy-4-(2-oxo-1,3-diphenyl-1,3,2λ5-diazaphospholidin-2-yl)oxolan-2-one

C18H19N2O4P — CID 118950286

IUPAC4-hydroxy-4-(2-oxo-1,3-diphenyl-1,3,2λ5-diazaphospholidin-2-yl)oxolan-2-one
SMILESO=C1CC(O)(P2(=O)N(c3ccccc3)CCN2c2ccccc2)CO1
InChIInChI=1S/C18H19N2O4P/c21-17-13-18(22,14-24-17)25(23)19(15-7-3-1-4-8-15)11-12-20(25)16-9-5-2-6-10-16/h1-10,22H,11-14H2
InChIKeyAQVIVQXCOGAGAR-UHFFFAOYSA-N
MW358.33 g/mol
LogP2.84
Rot. Bonds3

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

4-hydroxy-4-(2-oxo-1,3-diphenyl-1,3,2λ5-diazaphospholidin-2-yl)oxolan-2-one (PubChem CID 118950286) has the molecular formula C18H19N2O4P and a molecular weight of 358.33 g/mol. Its IUPAC name is 4-hydroxy-4-(2-oxo-1,3-diphenyl-1,3,2λ5-diazaphospholidin-2-yl)oxolan-2-one.

Molecular Properties

Compound Name4-hydroxy-4-(2-oxo-1,3-diphenyl-1,3,2λ5-diazaphospholidin-2-yl)oxolan-2-one
PubChem CID118950286
Molecular FormulaC18H19N2O4P
Molecular Weight358.33 g/mol
Exact Mass358.11
IUPAC Name4-hydroxy-4-(2-oxo-1,3-diphenyl-1,3,2λ5-diazaphospholidin-2-yl)oxolan-2-one
SMILESO=C1CC(O)(P2(=O)N(c3ccccc3)CCN2c2ccccc2)CO1
InChIInChI=1S/C18H19N2O4P/c21-17-13-18(22,14-24-17)25(23)19(15-7-3-1-4-8-15)11-12-20(25)16-9-5-2-6-10-16/h1-10,22H,11-14H2
InChIKeyAQVIVQXCOGAGAR-UHFFFAOYSA-N
XLogP2.84
TPSA70.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.33
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-4-(2-oxo-1,3-diphenyl-1,3,2λ5-diazaphospholidin-2-yl)oxolan-2-one?
The IUPAC name of 4-hydroxy-4-(2-oxo-1,3-diphenyl-1,3,2λ5-diazaphospholidin-2-yl)oxolan-2-one (CID 118950286) is 4-hydroxy-4-(2-oxo-1,3-diphenyl-1,3,2λ5-diazaphospholidin-2-yl)oxolan-2-one.
What is the SMILES notation for 4-hydroxy-4-(2-oxo-1,3-diphenyl-1,3,2λ5-diazaphospholidin-2-yl)oxolan-2-one?
The canonical SMILES for 4-hydroxy-4-(2-oxo-1,3-diphenyl-1,3,2λ5-diazaphospholidin-2-yl)oxolan-2-one is O=C1CC(O)(P2(=O)N(c3ccccc3)CCN2c2ccccc2)CO1.
What is the InChIKey of 4-hydroxy-4-(2-oxo-1,3-diphenyl-1,3,2λ5-diazaphospholidin-2-yl)oxolan-2-one?
The InChIKey is AQVIVQXCOGAGAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N2O4P/c21-17-13-18(22,14-24-17)25(23)19(15-7-3-1-4-8-15)11-12-20(25)16-9-5-2-6-10-16/h1-10,22H,11-14H2.
What are the key properties of 4-hydroxy-4-(2-oxo-1,3-diphenyl-1,3,2λ5-diazaphospholidin-2-yl)oxolan-2-one?
4-hydroxy-4-(2-oxo-1,3-diphenyl-1,3,2λ5-diazaphospholidin-2-yl)oxolan-2-one has a molecular weight of 358.33 g/mol, XLogP of 2.84, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-4-(2-oxo-1,3-diphenyl-1,3,2λ5-diazaphospholidin-2-yl)oxolan-2-one is sourced from PubChem (CID 118950286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).