(4R)-1-[(1S)-1-phenylethyl]-4-phenylmethoxypyrrolidin-2-one

C19H21NO2 — CID 134918156

IUPAC(4R)-1-[(1S)-1-phenylethyl]-4-phenylmethoxypyrrolidin-2-one
SMILESC[C@@H](c1ccccc1)N1C[C@H](OCc2ccccc2)CC1=O
InChIInChI=1S/C19H21NO2/c1-15(17-10-6-3-7-11-17)20-13-18(12-19(20)21)22-14-16-8-4-2-5-9-16/h2-11,15,18H,12-14H2,1H3/t15-,18+/m0/s1
InChIKeyUFKMSGMGFBGGIJ-MAUKXSAKSA-N
MW295.38 g/mol
LogP3.57
Rot. Bonds5

About (4R)-1-[(1S)-1-phenylethyl]-4-phenylmethoxypyrrolidin-2-one

(4R)-1-[(1S)-1-phenylethyl]-4-phenylmethoxypyrrolidin-2-one (PubChem CID 134918156) has the molecular formula C19H21NO2 and a molecular weight of 295.38 g/mol. Its IUPAC name is (4R)-1-[(1S)-1-phenylethyl]-4-phenylmethoxypyrrolidin-2-one.

Molecular Properties

Compound Name(4R)-1-[(1S)-1-phenylethyl]-4-phenylmethoxypyrrolidin-2-one
PubChem CID134918156
Molecular FormulaC19H21NO2
Molecular Weight295.38 g/mol
Exact Mass295.16
IUPAC Name(4R)-1-[(1S)-1-phenylethyl]-4-phenylmethoxypyrrolidin-2-one
SMILESC[C@@H](c1ccccc1)N1C[C@H](OCc2ccccc2)CC1=O
InChIInChI=1S/C19H21NO2/c1-15(17-10-6-3-7-11-17)20-13-18(12-19(20)21)22-14-16-8-4-2-5-9-16/h2-11,15,18H,12-14H2,1H3/t15-,18+/m0/s1
InChIKeyUFKMSGMGFBGGIJ-MAUKXSAKSA-N
XLogP3.57
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.38
LogP ≤ 53.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze (4R)-1-[(1S)-1-phenylethyl]-4-phenylmethoxypyrrolidin-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

Related Compounds

Benzyl (2R,4R)-4-methyl-5-oxo-2-phenyl-1,3-oxazolidine-3-carboxylate
CID 10566995
COX inhibitor, 5a
CID 12444099
3,4-Dimethyl-2,5-diphenyl-1,3-oxazolidine
CID 434347
1-Benzyl-2-methyl-3-phenylpyrrolidin-3-yl propanoate
CID 21149919
(3S-cis)-(+)-Tetrahydro-3,7a-diphenylpyrrolo[2,1-b]oxazol-5(6H)-one
CID 854037
COX inhibitor, 8
CID 11021865
N'-hydroxy-N-[(2S)-1-oxo-1-[[(1S)-1-phenylethyl]amino]-3-phenylmethoxybutan-2-yl]oxamide
CID 44384474
(2R)-2-acetamido-N-benzyl-3-phenylmethoxypropanamide
CID 46902056
1-[2-Benzyl-2-(phenylmethoxymethyl)pyrrolidin-1-yl]ethanone
CID 70694193
1-Methyl-2,3-diphenylpyrrolidin-3-yl propanoate
CID 21149891
2,5-Diphenyl-3,4-dimethyloxazolidine
CID 73585
(4R,5S)-3-butanoyl-4-methyl-5-phenyl-1,3-oxazolidin-2-one
CID 11118383

Frequently Asked Questions

What is the IUPAC name of (4R)-1-[(1S)-1-phenylethyl]-4-phenylmethoxypyrrolidin-2-one?
The IUPAC name of (4R)-1-[(1S)-1-phenylethyl]-4-phenylmethoxypyrrolidin-2-one (CID 134918156) is (4R)-1-[(1S)-1-phenylethyl]-4-phenylmethoxypyrrolidin-2-one.
What is the SMILES notation for (4R)-1-[(1S)-1-phenylethyl]-4-phenylmethoxypyrrolidin-2-one?
The canonical SMILES for (4R)-1-[(1S)-1-phenylethyl]-4-phenylmethoxypyrrolidin-2-one is C[C@@H](c1ccccc1)N1C[C@H](OCc2ccccc2)CC1=O.
What is the InChIKey of (4R)-1-[(1S)-1-phenylethyl]-4-phenylmethoxypyrrolidin-2-one?
The InChIKey is UFKMSGMGFBGGIJ-MAUKXSAKSA-N. The full InChI is InChI=1S/C19H21NO2/c1-15(17-10-6-3-7-11-17)20-13-18(12-19(20)21)22-14-16-8-4-2-5-9-16/h2-11,15,18H,12-14H2,1H3/t15-,18+/m0/s1.
What are the key properties of (4R)-1-[(1S)-1-phenylethyl]-4-phenylmethoxypyrrolidin-2-one?
(4R)-1-[(1S)-1-phenylethyl]-4-phenylmethoxypyrrolidin-2-one has a molecular weight of 295.38 g/mol, XLogP of 3.57, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-1-[(1S)-1-phenylethyl]-4-phenylmethoxypyrrolidin-2-one is sourced from PubChem (CID 134918156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).