2-[tert-butyl(dimethyl)silyl]oxy-2-(4-methylphenyl)-N-[(1R)-1-phenylethyl]acetamide

C23H33NO2Si — CID 59896203

IUPAC2-[tert-butyl(dimethyl)silyl]oxy-2-(4-methylphenyl)-N-[(1R)-1-phenylethyl]acetamide
SMILESCc1ccc(C(O[Si](C)(C)C(C)(C)C)C(=O)N[C@H](C)c2ccccc2)cc1
InChIInChI=1S/C23H33NO2Si/c1-17-13-15-20(16-14-17)21(26-27(6,7)23(3,4)5)22(25)24-18(2)19-11-9-8-10-12-19/h8-16,18,21H,1-7H3,(H,24,25)/t18-,21?/m1/s1
InChIKeyGUNDLRFMKWXWFX-ITUIMRKVSA-N
MW383.61 g/mol
LogP5.94
Rot. Bonds6

About 2-[tert-butyl(dimethyl)silyl]oxy-2-(4-methylphenyl)-N-[(1R)-1-phenylethyl]acetamide

2-[tert-butyl(dimethyl)silyl]oxy-2-(4-methylphenyl)-N-[(1R)-1-phenylethyl]acetamide (PubChem CID 59896203) has the molecular formula C23H33NO2Si and a molecular weight of 383.61 g/mol. Its IUPAC name is 2-[tert-butyl(dimethyl)silyl]oxy-2-(4-methylphenyl)-N-[(1R)-1-phenylethyl]acetamide.

Molecular Properties

Compound Name2-[tert-butyl(dimethyl)silyl]oxy-2-(4-methylphenyl)-N-[(1R)-1-phenylethyl]acetamide
PubChem CID59896203
Molecular FormulaC23H33NO2Si
Molecular Weight383.61 g/mol
Exact Mass383.23
IUPAC Name2-[tert-butyl(dimethyl)silyl]oxy-2-(4-methylphenyl)-N-[(1R)-1-phenylethyl]acetamide
SMILESCc1ccc(C(O[Si](C)(C)C(C)(C)C)C(=O)N[C@H](C)c2ccccc2)cc1
InChIInChI=1S/C23H33NO2Si/c1-17-13-15-20(16-14-17)21(26-27(6,7)23(3,4)5)22(25)24-18(2)19-11-9-8-10-12-19/h8-16,18,21H,1-7H3,(H,24,25)/t18-,21?/m1/s1
InChIKeyGUNDLRFMKWXWFX-ITUIMRKVSA-N
XLogP5.94
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500383.61
LogP ≤ 55.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

2-methoxy-N-[(4-methylphenyl)methyl]-2-phenylacetamide
CID 3142634
Benzeneacetamide, N-methyl-alpha-((trimethylsilyl)oxy)-
CID 3073653
(2R,3S)-3-[[(2R)-2-hydroxy-2-phenylacetyl]amino]-2-methyl-3-(4-methylphenyl)propanoic acid
CID 171347083
(2R,3S)-3-[[(2S)-2-hydroxy-2-phenylacetyl]amino]-2-methyl-3-(4-methylphenyl)propanoic acid
CID 171356060
N-((4-(1,1-Dimethylethyl)phenyl)methyl)-alpha-methoxybenzeneacetamide
CID 3709879
N-[2-(tert-Butyldimethylsilanyloxy)-2-phenylethyl]-2,6-difluorobenzamide
CID 139253362
N-[2-(tert-Butyldimethylsilanyloxy)-2-phenylethyl]-3,5-difluorobenzamide
CID 139253383
(3R,4S)-3-[(Triethylsilyl)oxy]-4-phenyl-2-azetidinone
CID 10826417
(3R,4S)-3-Triisopropylsilyloxy-4-phenyl-2-azetidinone
CID 10936090
(2S)-2-hydroxy-2-phenyl-N-[(1S)-1-phenylethyl]acetamide
CID 12641578
(3R,4S)-3-[tert-butyl(dimethyl)silyl]oxy-4-phenylazetidin-2-one
CID 14807861
(2S)-2-hydroxy-N-(2-hydroxy-1-phenylethyl)-2-phenylacetamide
CID 75483745

Frequently Asked Questions

What is the IUPAC name of 2-[tert-butyl(dimethyl)silyl]oxy-2-(4-methylphenyl)-N-[(1R)-1-phenylethyl]acetamide?
The IUPAC name of 2-[tert-butyl(dimethyl)silyl]oxy-2-(4-methylphenyl)-N-[(1R)-1-phenylethyl]acetamide (CID 59896203) is 2-[tert-butyl(dimethyl)silyl]oxy-2-(4-methylphenyl)-N-[(1R)-1-phenylethyl]acetamide.
What is the SMILES notation for 2-[tert-butyl(dimethyl)silyl]oxy-2-(4-methylphenyl)-N-[(1R)-1-phenylethyl]acetamide?
The canonical SMILES for 2-[tert-butyl(dimethyl)silyl]oxy-2-(4-methylphenyl)-N-[(1R)-1-phenylethyl]acetamide is Cc1ccc(C(O[Si](C)(C)C(C)(C)C)C(=O)N[C@H](C)c2ccccc2)cc1.
What is the InChIKey of 2-[tert-butyl(dimethyl)silyl]oxy-2-(4-methylphenyl)-N-[(1R)-1-phenylethyl]acetamide?
The InChIKey is GUNDLRFMKWXWFX-ITUIMRKVSA-N. The full InChI is InChI=1S/C23H33NO2Si/c1-17-13-15-20(16-14-17)21(26-27(6,7)23(3,4)5)22(25)24-18(2)19-11-9-8-10-12-19/h8-16,18,21H,1-7H3,(H,24,25)/t18-,21?/m1/s1.
What are the key properties of 2-[tert-butyl(dimethyl)silyl]oxy-2-(4-methylphenyl)-N-[(1R)-1-phenylethyl]acetamide?
2-[tert-butyl(dimethyl)silyl]oxy-2-(4-methylphenyl)-N-[(1R)-1-phenylethyl]acetamide has a molecular weight of 383.61 g/mol, XLogP of 5.94, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[tert-butyl(dimethyl)silyl]oxy-2-(4-methylphenyl)-N-[(1R)-1-phenylethyl]acetamide is sourced from PubChem (CID 59896203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).