(4R)-4-(2-hydroxyethyl)-3,3-diphenyl-1-propan-2-ylpyrrolidin-2-one

C21H25NO2 — CID 95560288

IUPAC(4R)-4-(2-hydroxyethyl)-3,3-diphenyl-1-propan-2-ylpyrrolidin-2-one
SMILESCC(C)N1C[C@H](CCO)C(c2ccccc2)(c2ccccc2)C1=O
InChIInChI=1S/C21H25NO2/c1-16(2)22-15-19(13-14-23)21(20(22)24,17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-12,16,19,23H,13-15H2,1-2H3/t19-/m0/s1
InChIKeyUSTQCZYHQIGDCY-IBGZPJMESA-N
MW323.44 g/mol
LogP3.22
Rot. Bonds5

About (4R)-4-(2-hydroxyethyl)-3,3-diphenyl-1-propan-2-ylpyrrolidin-2-one

(4R)-4-(2-hydroxyethyl)-3,3-diphenyl-1-propan-2-ylpyrrolidin-2-one (PubChem CID 95560288) has the molecular formula C21H25NO2 and a molecular weight of 323.44 g/mol. Its IUPAC name is (4R)-4-(2-hydroxyethyl)-3,3-diphenyl-1-propan-2-ylpyrrolidin-2-one.

Molecular Properties

Compound Name(4R)-4-(2-hydroxyethyl)-3,3-diphenyl-1-propan-2-ylpyrrolidin-2-one
PubChem CID95560288
Molecular FormulaC21H25NO2
Molecular Weight323.44 g/mol
Exact Mass323.19
IUPAC Name(4R)-4-(2-hydroxyethyl)-3,3-diphenyl-1-propan-2-ylpyrrolidin-2-one
SMILESCC(C)N1C[C@H](CCO)C(c2ccccc2)(c2ccccc2)C1=O
InChIInChI=1S/C21H25NO2/c1-16(2)22-15-19(13-14-23)21(20(22)24,17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-12,16,19,23H,13-15H2,1-2H3/t19-/m0/s1
InChIKeyUSTQCZYHQIGDCY-IBGZPJMESA-N
XLogP3.22
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.44
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (4R)-4-(2-hydroxyethyl)-3,3-diphenyl-1-propan-2-ylpyrrolidin-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 (4R)-4-(2-hydroxyethyl)-3,3-diphenyl-1-propan-2-ylpyrrolidin-2-one?
The IUPAC name of (4R)-4-(2-hydroxyethyl)-3,3-diphenyl-1-propan-2-ylpyrrolidin-2-one (CID 95560288) is (4R)-4-(2-hydroxyethyl)-3,3-diphenyl-1-propan-2-ylpyrrolidin-2-one.
What is the SMILES notation for (4R)-4-(2-hydroxyethyl)-3,3-diphenyl-1-propan-2-ylpyrrolidin-2-one?
The canonical SMILES for (4R)-4-(2-hydroxyethyl)-3,3-diphenyl-1-propan-2-ylpyrrolidin-2-one is CC(C)N1C[C@H](CCO)C(c2ccccc2)(c2ccccc2)C1=O.
What is the InChIKey of (4R)-4-(2-hydroxyethyl)-3,3-diphenyl-1-propan-2-ylpyrrolidin-2-one?
The InChIKey is USTQCZYHQIGDCY-IBGZPJMESA-N. The full InChI is InChI=1S/C21H25NO2/c1-16(2)22-15-19(13-14-23)21(20(22)24,17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-12,16,19,23H,13-15H2,1-2H3/t19-/m0/s1.
What are the key properties of (4R)-4-(2-hydroxyethyl)-3,3-diphenyl-1-propan-2-ylpyrrolidin-2-one?
(4R)-4-(2-hydroxyethyl)-3,3-diphenyl-1-propan-2-ylpyrrolidin-2-one has a molecular weight of 323.44 g/mol, XLogP of 3.22, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-(2-hydroxyethyl)-3,3-diphenyl-1-propan-2-ylpyrrolidin-2-one is sourced from PubChem (CID 95560288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).