4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-(2,2-dimethoxyethyl)benzamide

C19H33NO4Si — CID 69169813

IUPAC4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-(2,2-dimethoxyethyl)benzamide
SMILESCOC(CNC(=O)c1ccc(CCO[Si](C)(C)C(C)(C)C)cc1)OC
InChIInChI=1S/C19H33NO4Si/c1-19(2,3)25(6,7)24-13-12-15-8-10-16(11-9-15)18(21)20-14-17(22-4)23-5/h8-11,17H,12-14H2,1-7H3,(H,20,21)
InChIKeyQKGXDNWJKYHNDZ-UHFFFAOYSA-N
MW367.56 g/mol
LogP3.60
Rot. Bonds9

About 4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-(2,2-dimethoxyethyl)benzamide

4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-(2,2-dimethoxyethyl)benzamide (PubChem CID 69169813) has the molecular formula C19H33NO4Si and a molecular weight of 367.56 g/mol. Its IUPAC name is 4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-(2,2-dimethoxyethyl)benzamide.

Molecular Properties

Compound Name4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-(2,2-dimethoxyethyl)benzamide
PubChem CID69169813
Molecular FormulaC19H33NO4Si
Molecular Weight367.56 g/mol
Exact Mass367.22
IUPAC Name4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-(2,2-dimethoxyethyl)benzamide
SMILESCOC(CNC(=O)c1ccc(CCO[Si](C)(C)C(C)(C)C)cc1)OC
InChIInChI=1S/C19H33NO4Si/c1-19(2,3)25(6,7)24-13-12-15-8-10-16(11-9-15)18(21)20-14-17(22-4)23-5/h8-11,17H,12-14H2,1-7H3,(H,20,21)
InChIKeyQKGXDNWJKYHNDZ-UHFFFAOYSA-N
XLogP3.60
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.56
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

N-(2,2-dimethoxyethyl)-4-iodobenzamide
CID 10903782
1-[4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]phenyl]ethanol
CID 70662083
4-acetamido-N-(2,2-dimethoxyethyl)benzamide
CID 110463963
N-(2,2-dimethoxyethyl)-4-methylsulfanylbenzamide
CID 79214484
methyl 5-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-2-chlorobenzoate
CID 139036162
N-(2,2-dimethoxyethyl)-3-hydroxy-4-methoxybenzamide
CID 79726174
N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-3,5-dimethoxybenzamide
CID 134957452
N-(2,2-dimethoxyethyl)-3-(2-hydroxypropan-2-yl)benzamide
CID 110486080
4-[4-[tert-butyl(dimethyl)silyl]oxybutan-2-yloxymethyl]benzoic acid
CID 68630096
N-(2,2-dimethoxyethyl)-3,5-difluorobenzamide
CID 55025954
N-(2,2-dimethoxyethyl)-3-hydroxybenzamide
CID 60653076
1-[3-[tert-butyl(dimethyl)silyl]oxypropyl]-3-(2-phenylethyl)urea
CID 155933037

Frequently Asked Questions

What is the IUPAC name of 4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-(2,2-dimethoxyethyl)benzamide?
The IUPAC name of 4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-(2,2-dimethoxyethyl)benzamide (CID 69169813) is 4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-(2,2-dimethoxyethyl)benzamide.
What is the SMILES notation for 4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-(2,2-dimethoxyethyl)benzamide?
The canonical SMILES for 4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-(2,2-dimethoxyethyl)benzamide is COC(CNC(=O)c1ccc(CCO[Si](C)(C)C(C)(C)C)cc1)OC.
What is the InChIKey of 4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-(2,2-dimethoxyethyl)benzamide?
The InChIKey is QKGXDNWJKYHNDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H33NO4Si/c1-19(2,3)25(6,7)24-13-12-15-8-10-16(11-9-15)18(21)20-14-17(22-4)23-5/h8-11,17H,12-14H2,1-7H3,(H,20,21).
What are the key properties of 4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-(2,2-dimethoxyethyl)benzamide?
4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-(2,2-dimethoxyethyl)benzamide has a molecular weight of 367.56 g/mol, XLogP of 3.60, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-(2,2-dimethoxyethyl)benzamide is sourced from PubChem (CID 69169813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).