5-methyl-3,3-diphenylpyrrolidin-2-one

C17H17NO — CID 23263862

IUPAC5-methyl-3,3-diphenylpyrrolidin-2-one
SMILESCC1CC(c2ccccc2)(c2ccccc2)C(=O)N1
InChIInChI=1S/C17H17NO/c1-13-12-17(16(19)18-13,14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2-11,13H,12H2,1H3,(H,18,19)
InChIKeyLPXJHERLIUMBIN-UHFFFAOYSA-N
MW251.33 g/mol
LogP2.88
Rot. Bonds2

About 5-methyl-3,3-diphenylpyrrolidin-2-one

5-methyl-3,3-diphenylpyrrolidin-2-one (PubChem CID 23263862) has the molecular formula C17H17NO and a molecular weight of 251.33 g/mol. Its IUPAC name is 5-methyl-3,3-diphenylpyrrolidin-2-one.

Molecular Properties

Compound Name5-methyl-3,3-diphenylpyrrolidin-2-one
PubChem CID23263862
Molecular FormulaC17H17NO
Molecular Weight251.33 g/mol
Exact Mass251.13
IUPAC Name5-methyl-3,3-diphenylpyrrolidin-2-one
SMILESCC1CC(c2ccccc2)(c2ccccc2)C(=O)N1
InChIInChI=1S/C17H17NO/c1-13-12-17(16(19)18-13,14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2-11,13H,12H2,1H3,(H,18,19)
InChIKeyLPXJHERLIUMBIN-UHFFFAOYSA-N
XLogP2.88
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-3,3-diphenylpyrrolidin-2-one?
The IUPAC name of 5-methyl-3,3-diphenylpyrrolidin-2-one (CID 23263862) is 5-methyl-3,3-diphenylpyrrolidin-2-one.
What is the SMILES notation for 5-methyl-3,3-diphenylpyrrolidin-2-one?
The canonical SMILES for 5-methyl-3,3-diphenylpyrrolidin-2-one is CC1CC(c2ccccc2)(c2ccccc2)C(=O)N1.
What is the InChIKey of 5-methyl-3,3-diphenylpyrrolidin-2-one?
The InChIKey is LPXJHERLIUMBIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17NO/c1-13-12-17(16(19)18-13,14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2-11,13H,12H2,1H3,(H,18,19).
What are the key properties of 5-methyl-3,3-diphenylpyrrolidin-2-one?
5-methyl-3,3-diphenylpyrrolidin-2-one has a molecular weight of 251.33 g/mol, XLogP of 2.88, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-3,3-diphenylpyrrolidin-2-one is sourced from PubChem (CID 23263862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).