methyl (2S)-2-[(2R)-4-oxo-2-phenyl-2,3-dihydropyridin-1-yl]-2-phenylacetate

C20H19NO3 — CID 10087413

IUPACmethyl (2S)-2-[(2R)-4-oxo-2-phenyl-2,3-dihydropyridin-1-yl]-2-phenylacetate
SMILESCOC(=O)[C@H](c1ccccc1)N1C=CC(=O)C[C@@H]1c1ccccc1
InChIInChI=1S/C20H19NO3/c1-24-20(23)19(16-10-6-3-7-11-16)21-13-12-17(22)14-18(21)15-8-4-2-5-9-15/h2-13,18-19H,14H2,1H3/t18-,19+/m1/s1
InChIKeyVXBUPCFBNSPKPS-MOPGFXCFSA-N
MW321.38 g/mol
LogP3.43
Rot. Bonds4

About methyl (2S)-2-[(2R)-4-oxo-2-phenyl-2,3-dihydropyridin-1-yl]-2-phenylacetate

methyl (2S)-2-[(2R)-4-oxo-2-phenyl-2,3-dihydropyridin-1-yl]-2-phenylacetate (PubChem CID 10087413) has the molecular formula C20H19NO3 and a molecular weight of 321.38 g/mol. Its IUPAC name is methyl (2S)-2-[(2R)-4-oxo-2-phenyl-2,3-dihydropyridin-1-yl]-2-phenylacetate.

Molecular Properties

Compound Namemethyl (2S)-2-[(2R)-4-oxo-2-phenyl-2,3-dihydropyridin-1-yl]-2-phenylacetate
PubChem CID10087413
Molecular FormulaC20H19NO3
Molecular Weight321.38 g/mol
Exact Mass321.14
IUPAC Namemethyl (2S)-2-[(2R)-4-oxo-2-phenyl-2,3-dihydropyridin-1-yl]-2-phenylacetate
SMILESCOC(=O)[C@H](c1ccccc1)N1C=CC(=O)C[C@@H]1c1ccccc1
InChIInChI=1S/C20H19NO3/c1-24-20(23)19(16-10-6-3-7-11-16)21-13-12-17(22)14-18(21)15-8-4-2-5-9-15/h2-13,18-19H,14H2,1H3/t18-,19+/m1/s1
InChIKeyVXBUPCFBNSPKPS-MOPGFXCFSA-N
XLogP3.43
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.38
LogP ≤ 53.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze methyl (2S)-2-[(2R)-4-oxo-2-phenyl-2,3-dihydropyridin-1-yl]-2-phenylacetate 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

methyl (2S)-2-phenyl-2-[(2R)-2-phenylpyrrolidin-1-yl]acetate
CID 102206721
methyl 2-(3-hydroxy-2-oxo-4-phenylazetidin-1-yl)-2-phenylacetate
CID 20522495
methyl (2S)-2-[(2R)-2-(4-methoxyphenyl)-4-oxo-2,3-dihydropyridin-1-yl]-3-methylpentanoate
CID 11724260
1-(1-phenylethyl)-2-pyridin-3-yl-2,3-dihydropyridin-4-one
CID 73084017
methyl 2-phenyl-2-piperidin-1-ylacetate
CID 12957460
methyl 2-[(2R)-3-hydroxy-2-phenyl-2,4-dihydroquinazolin-1-yl]-2-phenylacetate
CID 151945368
4-(2-methoxy-2-oxo-1-phenylethyl)piperazine-1-carboxylic acid
CID 22353154
methyl 2-(1,1-dioxothiazetidin-2-yl)-2-phenylacetate
CID 101164706
1-(2-methoxy-2-oxo-1-phenylethyl)-6-oxopyridine-3-carboxylic acid
CID 62109020
N-(2-bromo-4,5-dimethoxyphenyl)-4-oxo-2-phenyl-2,3-dihydropyridine-1-carboxamide
CID 46831213
1-[2-(2-chloro-4,5-dimethoxyphenyl)acetyl]-2-phenyl-2,3-dihydropyridin-4-one
CID 59377692
1-[2-(2-bromo-4,5-dimethoxyphenyl)acetyl]-2-phenyl-2,3-dihydropyridin-4-one
CID 46834941

Frequently Asked Questions

What is the IUPAC name of methyl (2S)-2-[(2R)-4-oxo-2-phenyl-2,3-dihydropyridin-1-yl]-2-phenylacetate?
The IUPAC name of methyl (2S)-2-[(2R)-4-oxo-2-phenyl-2,3-dihydropyridin-1-yl]-2-phenylacetate (CID 10087413) is methyl (2S)-2-[(2R)-4-oxo-2-phenyl-2,3-dihydropyridin-1-yl]-2-phenylacetate.
What is the SMILES notation for methyl (2S)-2-[(2R)-4-oxo-2-phenyl-2,3-dihydropyridin-1-yl]-2-phenylacetate?
The canonical SMILES for methyl (2S)-2-[(2R)-4-oxo-2-phenyl-2,3-dihydropyridin-1-yl]-2-phenylacetate is COC(=O)[C@H](c1ccccc1)N1C=CC(=O)C[C@@H]1c1ccccc1.
What is the InChIKey of methyl (2S)-2-[(2R)-4-oxo-2-phenyl-2,3-dihydropyridin-1-yl]-2-phenylacetate?
The InChIKey is VXBUPCFBNSPKPS-MOPGFXCFSA-N. The full InChI is InChI=1S/C20H19NO3/c1-24-20(23)19(16-10-6-3-7-11-16)21-13-12-17(22)14-18(21)15-8-4-2-5-9-15/h2-13,18-19H,14H2,1H3/t18-,19+/m1/s1.
What are the key properties of methyl (2S)-2-[(2R)-4-oxo-2-phenyl-2,3-dihydropyridin-1-yl]-2-phenylacetate?
methyl (2S)-2-[(2R)-4-oxo-2-phenyl-2,3-dihydropyridin-1-yl]-2-phenylacetate has a molecular weight of 321.38 g/mol, XLogP of 3.43, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl (2S)-2-[(2R)-4-oxo-2-phenyl-2,3-dihydropyridin-1-yl]-2-phenylacetate is sourced from PubChem (CID 10087413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).