(4R)-1-benzyl-4-[hydroxy(diphenyl)methyl]pyrrolidin-2-one

C24H23NO2 — CID 92845757

IUPAC(4R)-1-benzyl-4-[hydroxy(diphenyl)methyl]pyrrolidin-2-one
SMILESO=C1C[C@@H](C(O)(c2ccccc2)c2ccccc2)CN1Cc1ccccc1
InChIInChI=1S/C24H23NO2/c26-23-16-22(18-25(23)17-19-10-4-1-5-11-19)24(27,20-12-6-2-7-13-20)21-14-8-3-9-15-21/h1-15,22,27H,16-18H2/t22-/m1/s1
InChIKeyMLNFLZGBAGZYSJ-JOCHJYFZSA-N
MW357.45 g/mol
LogP3.97
Rot. Bonds5

About (4R)-1-benzyl-4-[hydroxy(diphenyl)methyl]pyrrolidin-2-one

(4R)-1-benzyl-4-[hydroxy(diphenyl)methyl]pyrrolidin-2-one (PubChem CID 92845757) has the molecular formula C24H23NO2 and a molecular weight of 357.45 g/mol. Its IUPAC name is (4R)-1-benzyl-4-[hydroxy(diphenyl)methyl]pyrrolidin-2-one.

Molecular Properties

Compound Name(4R)-1-benzyl-4-[hydroxy(diphenyl)methyl]pyrrolidin-2-one
PubChem CID92845757
Molecular FormulaC24H23NO2
Molecular Weight357.45 g/mol
Exact Mass357.17
IUPAC Name(4R)-1-benzyl-4-[hydroxy(diphenyl)methyl]pyrrolidin-2-one
SMILESO=C1C[C@@H](C(O)(c2ccccc2)c2ccccc2)CN1Cc1ccccc1
InChIInChI=1S/C24H23NO2/c26-23-16-22(18-25(23)17-19-10-4-1-5-11-19)24(27,20-12-6-2-7-13-20)21-14-8-3-9-15-21/h1-15,22,27H,16-18H2/t22-/m1/s1
InChIKeyMLNFLZGBAGZYSJ-JOCHJYFZSA-N
XLogP3.97
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.45
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(4aS,8aS)-2-benzyl-1,4,4a,5,6,7,8,8a-octahydroisoquinolin-3-one
CID 10490446
1-benzyl-4-(bromomethyl)pyrrolidin-2-one
CID 46703995
2-(1-benzyl-5-oxopyrrolidin-3-yl)-N-methylacetamide
CID 139763375
1-[(4-benzylphenyl)methyl]-4-sulfanylpyrrolidin-2-one
CID 22292958
N,1-dibenzyl-5-oxo-N-phenylpyrrolidine-3-carboxamide
CID 75981218
(4R)-1-benzyl-4-(furan-2-yl)pyrrolidin-2-one
CID 102377410
1-(1-benzyl-5-oxopyrrolidin-3-yl)-3-tert-butylurea
CID 108876426
N-[(1-benzyl-5-oxopyrrolidin-3-yl)methyl]-2-phenylacetamide
CID 16919346
1-[(3-aminophenyl)methyl]-4-tert-butylpyrrolidin-2-one
CID 104510947
1-benzyl-4-(2,3-dihydro-1H-inden-2-ylamino)pyrrolidin-2-one
CID 154860377
4-(2-phenylpropan-2-yl)-1-propylpyrrolidin-2-one
CID 123589001
1-benzyl-N-(2-tert-butylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 17396518

Frequently Asked Questions

What is the IUPAC name of (4R)-1-benzyl-4-[hydroxy(diphenyl)methyl]pyrrolidin-2-one?
The IUPAC name of (4R)-1-benzyl-4-[hydroxy(diphenyl)methyl]pyrrolidin-2-one (CID 92845757) is (4R)-1-benzyl-4-[hydroxy(diphenyl)methyl]pyrrolidin-2-one.
What is the SMILES notation for (4R)-1-benzyl-4-[hydroxy(diphenyl)methyl]pyrrolidin-2-one?
The canonical SMILES for (4R)-1-benzyl-4-[hydroxy(diphenyl)methyl]pyrrolidin-2-one is O=C1C[C@@H](C(O)(c2ccccc2)c2ccccc2)CN1Cc1ccccc1.
What is the InChIKey of (4R)-1-benzyl-4-[hydroxy(diphenyl)methyl]pyrrolidin-2-one?
The InChIKey is MLNFLZGBAGZYSJ-JOCHJYFZSA-N. The full InChI is InChI=1S/C24H23NO2/c26-23-16-22(18-25(23)17-19-10-4-1-5-11-19)24(27,20-12-6-2-7-13-20)21-14-8-3-9-15-21/h1-15,22,27H,16-18H2/t22-/m1/s1.
What are the key properties of (4R)-1-benzyl-4-[hydroxy(diphenyl)methyl]pyrrolidin-2-one?
(4R)-1-benzyl-4-[hydroxy(diphenyl)methyl]pyrrolidin-2-one has a molecular weight of 357.45 g/mol, XLogP of 3.97, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-1-benzyl-4-[hydroxy(diphenyl)methyl]pyrrolidin-2-one is sourced from PubChem (CID 92845757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).