1-[(2R)-1-(2-methylpropoxy)-3-(4-phenylphenyl)propan-2-yl]pyrrolidine-2,5-dione

C23H27NO3 — CID 144581499

IUPAC1-[(2R)-1-(2-methylpropoxy)-3-(4-phenylphenyl)propan-2-yl]pyrrolidine-2,5-dione
SMILESCC(C)COCC(Cc1ccc(-c2ccccc2)cc1)N1C(=O)CCC1=O
InChIInChI=1S/C23H27NO3/c1-17(2)15-27-16-21(24-22(25)12-13-23(24)26)14-18-8-10-20(11-9-18)19-6-4-3-5-7-19/h3-11,17,21H,12-16H2,1-2H3
InChIKeyGRTKZISRGFKRDJ-UHFFFAOYSA-N
MW365.47 g/mol
LogP4.09
Rot. Bonds8

About 1-[(2R)-1-(2-methylpropoxy)-3-(4-phenylphenyl)propan-2-yl]pyrrolidine-2,5-dione

1-[(2R)-1-(2-methylpropoxy)-3-(4-phenylphenyl)propan-2-yl]pyrrolidine-2,5-dione (PubChem CID 144581499) has the molecular formula C23H27NO3 and a molecular weight of 365.47 g/mol. Its IUPAC name is 1-[(2R)-1-(2-methylpropoxy)-3-(4-phenylphenyl)propan-2-yl]pyrrolidine-2,5-dione.

Molecular Properties

Compound Name1-[(2R)-1-(2-methylpropoxy)-3-(4-phenylphenyl)propan-2-yl]pyrrolidine-2,5-dione
PubChem CID144581499
Molecular FormulaC23H27NO3
Molecular Weight365.47 g/mol
Exact Mass365.20
IUPAC Name1-[(2R)-1-(2-methylpropoxy)-3-(4-phenylphenyl)propan-2-yl]pyrrolidine-2,5-dione
SMILESCC(C)COCC(Cc1ccc(-c2ccccc2)cc1)N1C(=O)CCC1=O
InChIInChI=1S/C23H27NO3/c1-17(2)15-27-16-21(24-22(25)12-13-23(24)26)14-18-8-10-20(11-9-18)19-6-4-3-5-7-19/h3-11,17,21H,12-16H2,1-2H3
InChIKeyGRTKZISRGFKRDJ-UHFFFAOYSA-N
XLogP4.09
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.47
LogP ≤ 54.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 1-[(2R)-1-(2-methylpropoxy)-3-(4-phenylphenyl)propan-2-yl]pyrrolidine-2,5-dione 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 1-[(2R)-1-(2-methylpropoxy)-3-(4-phenylphenyl)propan-2-yl]pyrrolidine-2,5-dione?
The IUPAC name of 1-[(2R)-1-(2-methylpropoxy)-3-(4-phenylphenyl)propan-2-yl]pyrrolidine-2,5-dione (CID 144581499) is 1-[(2R)-1-(2-methylpropoxy)-3-(4-phenylphenyl)propan-2-yl]pyrrolidine-2,5-dione.
What is the SMILES notation for 1-[(2R)-1-(2-methylpropoxy)-3-(4-phenylphenyl)propan-2-yl]pyrrolidine-2,5-dione?
The canonical SMILES for 1-[(2R)-1-(2-methylpropoxy)-3-(4-phenylphenyl)propan-2-yl]pyrrolidine-2,5-dione is CC(C)COCC(Cc1ccc(-c2ccccc2)cc1)N1C(=O)CCC1=O.
What is the InChIKey of 1-[(2R)-1-(2-methylpropoxy)-3-(4-phenylphenyl)propan-2-yl]pyrrolidine-2,5-dione?
The InChIKey is GRTKZISRGFKRDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H27NO3/c1-17(2)15-27-16-21(24-22(25)12-13-23(24)26)14-18-8-10-20(11-9-18)19-6-4-3-5-7-19/h3-11,17,21H,12-16H2,1-2H3.
What are the key properties of 1-[(2R)-1-(2-methylpropoxy)-3-(4-phenylphenyl)propan-2-yl]pyrrolidine-2,5-dione?
1-[(2R)-1-(2-methylpropoxy)-3-(4-phenylphenyl)propan-2-yl]pyrrolidine-2,5-dione has a molecular weight of 365.47 g/mol, XLogP of 4.09, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2R)-1-(2-methylpropoxy)-3-(4-phenylphenyl)propan-2-yl]pyrrolidine-2,5-dione is sourced from PubChem (CID 144581499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).