4-[[tert-butyl(dimethyl)silyl]oxymethyl]-N-methoxy-N-methylbenzamide

C16H27NO3Si — CID 89407391

IUPAC4-[[tert-butyl(dimethyl)silyl]oxymethyl]-N-methoxy-N-methylbenzamide
SMILESCON(C)C(=O)c1ccc(CO[Si](C)(C)C(C)(C)C)cc1
InChIInChI=1S/C16H27NO3Si/c1-16(2,3)21(6,7)20-12-13-8-10-14(11-9-13)15(18)17(4)19-5/h8-11H,12H2,1-7H3
InChIKeyKVFBLGQKJKKIOR-UHFFFAOYSA-N
MW309.48 g/mol
LogP3.84
Rot. Bonds5

About 4-[[tert-butyl(dimethyl)silyl]oxymethyl]-N-methoxy-N-methylbenzamide

4-[[tert-butyl(dimethyl)silyl]oxymethyl]-N-methoxy-N-methylbenzamide (PubChem CID 89407391) has the molecular formula C16H27NO3Si and a molecular weight of 309.48 g/mol. Its IUPAC name is 4-[[tert-butyl(dimethyl)silyl]oxymethyl]-N-methoxy-N-methylbenzamide.

Molecular Properties

Compound Name4-[[tert-butyl(dimethyl)silyl]oxymethyl]-N-methoxy-N-methylbenzamide
PubChem CID89407391
Molecular FormulaC16H27NO3Si
Molecular Weight309.48 g/mol
Exact Mass309.18
IUPAC Name4-[[tert-butyl(dimethyl)silyl]oxymethyl]-N-methoxy-N-methylbenzamide
SMILESCON(C)C(=O)c1ccc(CO[Si](C)(C)C(C)(C)C)cc1
InChIInChI=1S/C16H27NO3Si/c1-16(2,3)21(6,7)20-12-13-8-10-14(11-9-13)15(18)17(4)19-5/h8-11H,12H2,1-7H3
InChIKeyKVFBLGQKJKKIOR-UHFFFAOYSA-N
XLogP3.84
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.48
LogP ≤ 53.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(4-methylphenyl)-N-[(4-methylphenyl)methoxy]carboxamide
CID 4776030
4-Dimethylcarbamoylbenzyl alcohol
CID 194108
Methyl 4-[methoxy(methyl)carbamoyl]benzoate
CID 54447022
N-methyl-N-phenylmethoxybenzamide
CID 57981059
4-[Methoxy(methyl)carbamoyl]benzoic acid
CID 102492872
neptunium;N-phenylmethoxy-N-prop-2-enylbenzamide
CID 134847083
neptunium;N-phenylmethoxy-N-prop-2-enylbenzamide
CID 134847085
4-[(Z)-dec-1-enyl]-N-methyl-N-phenylmethoxybenzamide
CID 13672799
4-(3-bromopropyl)-N-methyl-N-phenylmethoxybenzamide
CID 14425145
3-[tert-butyl(dimethyl)silyl]oxy-N-methoxy-N-methylbenzamide
CID 20610043
N-methoxy-N-methyl-3-trimethylsilylbenzamide
CID 21469712
N-Methoxy-4-[(2-methoxyethoxy)methyl]-N-methylbenzamide
CID 22015586

Frequently Asked Questions

What is the IUPAC name of 4-[[tert-butyl(dimethyl)silyl]oxymethyl]-N-methoxy-N-methylbenzamide?
The IUPAC name of 4-[[tert-butyl(dimethyl)silyl]oxymethyl]-N-methoxy-N-methylbenzamide (CID 89407391) is 4-[[tert-butyl(dimethyl)silyl]oxymethyl]-N-methoxy-N-methylbenzamide.
What is the SMILES notation for 4-[[tert-butyl(dimethyl)silyl]oxymethyl]-N-methoxy-N-methylbenzamide?
The canonical SMILES for 4-[[tert-butyl(dimethyl)silyl]oxymethyl]-N-methoxy-N-methylbenzamide is CON(C)C(=O)c1ccc(CO[Si](C)(C)C(C)(C)C)cc1.
What is the InChIKey of 4-[[tert-butyl(dimethyl)silyl]oxymethyl]-N-methoxy-N-methylbenzamide?
The InChIKey is KVFBLGQKJKKIOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27NO3Si/c1-16(2,3)21(6,7)20-12-13-8-10-14(11-9-13)15(18)17(4)19-5/h8-11H,12H2,1-7H3.
What are the key properties of 4-[[tert-butyl(dimethyl)silyl]oxymethyl]-N-methoxy-N-methylbenzamide?
4-[[tert-butyl(dimethyl)silyl]oxymethyl]-N-methoxy-N-methylbenzamide has a molecular weight of 309.48 g/mol, XLogP of 3.84, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[tert-butyl(dimethyl)silyl]oxymethyl]-N-methoxy-N-methylbenzamide is sourced from PubChem (CID 89407391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).