[2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl] 2-hydroxy-2,2-diphenylacetate

C24H23NO4 — CID 2673402

IUPAC[2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl] 2-hydroxy-2,2-diphenylacetate
SMILESC[C@@H](NC(=O)COC(=O)C(O)(c1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C24H23NO4/c1-18(19-11-5-2-6-12-19)25-22(26)17-29-23(27)24(28,20-13-7-3-8-14-20)21-15-9-4-10-16-21/h2-16,18,28H,17H2,1H3,(H,25,26)/t18-/m1/s1
InChIKeyPUDNGEVKUXASOC-GOSISDBHSA-N
MW389.45 g/mol
LogP3.34
Rot. Bonds7

About [2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl] 2-hydroxy-2,2-diphenylacetate

[2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl] 2-hydroxy-2,2-diphenylacetate (PubChem CID 2673402) has the molecular formula C24H23NO4 and a molecular weight of 389.45 g/mol. Its IUPAC name is [2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl] 2-hydroxy-2,2-diphenylacetate.

Molecular Properties

Compound Name[2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl] 2-hydroxy-2,2-diphenylacetate
PubChem CID2673402
Molecular FormulaC24H23NO4
Molecular Weight389.45 g/mol
Exact Mass389.16
IUPAC Name[2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl] 2-hydroxy-2,2-diphenylacetate
SMILESC[C@@H](NC(=O)COC(=O)C(O)(c1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C24H23NO4/c1-18(19-11-5-2-6-12-19)25-22(26)17-29-23(27)24(28,20-13-7-3-8-14-20)21-15-9-4-10-16-21/h2-16,18,28H,17H2,1H3,(H,25,26)/t18-/m1/s1
InChIKeyPUDNGEVKUXASOC-GOSISDBHSA-N
XLogP3.34
TPSA75.63 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.45
LogP ≤ 53.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze [2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl] 2-hydroxy-2,2-diphenylacetate with MolForge

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Related Compounds

[2-[[(2R)-3-methylbutan-2-yl]amino]-2-oxoethyl] 2-hydroxy-2,2-diphenylacetate
CID 2675463
2-[2-oxo-2-(1-phenylethylamino)ethoxy]-N-(1-phenylethyl)acetamide
CID 85140182
2-methoxy-N-[(1S)-1-phenylethyl]acetamide
CID 835320
[2-oxo-2-[[(1S)-1-phenylethyl]amino]ethyl] (2S)-2-[(4-tert-butylbenzoyl)amino]propanoate
CID 8882191
[2-oxo-2-[[(1S)-1-phenylethyl]amino]ethyl] 4-bromobenzoate
CID 2625805
[2-oxo-2-[[(1S)-1-phenylethyl]amino]ethyl] 2-benzamidoacetate
CID 2367537
3,3-dimethyl-N-(1-phenylethyl)butanamide
CID 5156149
2-amino-N-(1-phenylethyl)acetamide
CID 10631169
[2-oxo-2-[[(1S)-1-phenylethyl]amino]ethyl] pyridine-4-carboxylate
CID 7783953
[2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl] 2-iodobenzoate
CID 2509775
[2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl] 2-[3-(trifluoromethyl)phenoxy]acetate
CID 7853969
[2-[[(1R)-1-(4-bromophenyl)ethyl]amino]-2-oxoethyl] (2S)-2-phenylbutanoate
CID 8753833

Frequently Asked Questions

What is the IUPAC name of [2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl] 2-hydroxy-2,2-diphenylacetate?
The IUPAC name of [2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl] 2-hydroxy-2,2-diphenylacetate (CID 2673402) is [2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl] 2-hydroxy-2,2-diphenylacetate.
What is the SMILES notation for [2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl] 2-hydroxy-2,2-diphenylacetate?
The canonical SMILES for [2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl] 2-hydroxy-2,2-diphenylacetate is C[C@@H](NC(=O)COC(=O)C(O)(c1ccccc1)c1ccccc1)c1ccccc1.
What is the InChIKey of [2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl] 2-hydroxy-2,2-diphenylacetate?
The InChIKey is PUDNGEVKUXASOC-GOSISDBHSA-N. The full InChI is InChI=1S/C24H23NO4/c1-18(19-11-5-2-6-12-19)25-22(26)17-29-23(27)24(28,20-13-7-3-8-14-20)21-15-9-4-10-16-21/h2-16,18,28H,17H2,1H3,(H,25,26)/t18-/m1/s1.
What are the key properties of [2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl] 2-hydroxy-2,2-diphenylacetate?
[2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl] 2-hydroxy-2,2-diphenylacetate has a molecular weight of 389.45 g/mol, XLogP of 3.34, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl] 2-hydroxy-2,2-diphenylacetate is sourced from PubChem (CID 2673402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).