2-[tert-butyl(diphenyl)silyl]-N-hydroxy-N-methoxyprop-2-enamide

C20H25NO3Si — CID 172805254

IUPAC2-[tert-butyl(diphenyl)silyl]-N-hydroxy-N-methoxyprop-2-enamide
SMILESC=C(C(=O)N(O)OC)[Si](c1ccccc1)(c1ccccc1)C(C)(C)C
InChIInChI=1S/C20H25NO3Si/c1-16(19(22)21(23)24-5)25(20(2,3)4,17-12-8-6-9-13-17)18-14-10-7-11-15-18/h6-15,23H,1H2,2-5H3
InChIKeyRKOISJFGZGCCDK-UHFFFAOYSA-N
MW355.51 g/mol
LogP2.92
Rot. Bonds5

About 2-[tert-butyl(diphenyl)silyl]-N-hydroxy-N-methoxyprop-2-enamide

2-[tert-butyl(diphenyl)silyl]-N-hydroxy-N-methoxyprop-2-enamide (PubChem CID 172805254) has the molecular formula C20H25NO3Si and a molecular weight of 355.51 g/mol. Its IUPAC name is 2-[tert-butyl(diphenyl)silyl]-N-hydroxy-N-methoxyprop-2-enamide.

Molecular Properties

Compound Name2-[tert-butyl(diphenyl)silyl]-N-hydroxy-N-methoxyprop-2-enamide
PubChem CID172805254
Molecular FormulaC20H25NO3Si
Molecular Weight355.51 g/mol
Exact Mass355.16
IUPAC Name2-[tert-butyl(diphenyl)silyl]-N-hydroxy-N-methoxyprop-2-enamide
SMILESC=C(C(=O)N(O)OC)[Si](c1ccccc1)(c1ccccc1)C(C)(C)C
InChIInChI=1S/C20H25NO3Si/c1-16(19(22)21(23)24-5)25(20(2,3)4,17-12-8-6-9-13-17)18-14-10-7-11-15-18/h6-15,23H,1H2,2-5H3
InChIKeyRKOISJFGZGCCDK-UHFFFAOYSA-N
XLogP2.92
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.51
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[(2R,3R)-5-[tert-butyl(diphenyl)silyl]-3-hydroxy-3-methyl-4-oxohex-5-en-2-yl] acetate
CID 10928017
1-[tert-butyl(diphenyl)silyl]-2,2-difluoroethanone
CID 11472623
1-[tert-butyl(diphenyl)silyl]-2-fluoroethanone
CID 86211351
1-[tert-butyl(diphenyl)silyl]-2-[hydroxy-(4-methoxyphenyl)methyl]prop-2-en-1-one
CID 10741300
tert-butyl-hex-1-en-2-yl-diphenylsilane
CID 10314087
2-[[tert-butyl(diphenyl)silyl]oxymethyl]prop-2-enoic acid
CID 67253789
tert-butyl-(1-methoxyethenoxy)-diphenylsilane
CID 10662951
tert-butyl-diphenyl-(1-phenylpropa-1,2-dienyl)silane
CID 11210438
tert-butyl-(2-chloroprop-2-enoxy)-diphenylsilane
CID 138969032
4-[tert-butyl(diphenyl)silyl]oxy-N-methoxy-N-methylcyclohexane-1-carboxamide
CID 89407420
[tert-butyl(diphenyl)silyl] 2,2-dimethylpropanoate
CID 22445131
5-[tert-butyl(diphenyl)silyl]oxypentyl 2-methylprop-2-enoate
CID 172860642

Frequently Asked Questions

What is the IUPAC name of 2-[tert-butyl(diphenyl)silyl]-N-hydroxy-N-methoxyprop-2-enamide?
The IUPAC name of 2-[tert-butyl(diphenyl)silyl]-N-hydroxy-N-methoxyprop-2-enamide (CID 172805254) is 2-[tert-butyl(diphenyl)silyl]-N-hydroxy-N-methoxyprop-2-enamide.
What is the SMILES notation for 2-[tert-butyl(diphenyl)silyl]-N-hydroxy-N-methoxyprop-2-enamide?
The canonical SMILES for 2-[tert-butyl(diphenyl)silyl]-N-hydroxy-N-methoxyprop-2-enamide is C=C(C(=O)N(O)OC)[Si](c1ccccc1)(c1ccccc1)C(C)(C)C.
What is the InChIKey of 2-[tert-butyl(diphenyl)silyl]-N-hydroxy-N-methoxyprop-2-enamide?
The InChIKey is RKOISJFGZGCCDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO3Si/c1-16(19(22)21(23)24-5)25(20(2,3)4,17-12-8-6-9-13-17)18-14-10-7-11-15-18/h6-15,23H,1H2,2-5H3.
What are the key properties of 2-[tert-butyl(diphenyl)silyl]-N-hydroxy-N-methoxyprop-2-enamide?
2-[tert-butyl(diphenyl)silyl]-N-hydroxy-N-methoxyprop-2-enamide has a molecular weight of 355.51 g/mol, XLogP of 2.92, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[tert-butyl(diphenyl)silyl]-N-hydroxy-N-methoxyprop-2-enamide is sourced from PubChem (CID 172805254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).