4-[tert-butyl(dimethyl)silyl]oxy-N,N-diethylbenzamide

C17H29NO2Si — CID 58586309

IUPAC4-[tert-butyl(dimethyl)silyl]oxy-N,N-diethylbenzamide
SMILESCCN(CC)C(=O)c1ccc(O[Si](C)(C)C(C)(C)C)cc1
InChIInChI=1S/C17H29NO2Si/c1-8-18(9-2)16(19)14-10-12-15(13-11-14)20-21(6,7)17(3,4)5/h10-13H,8-9H2,1-7H3
InChIKeyCJPUCPOWMFGQAV-UHFFFAOYSA-N
MW307.51 g/mol
LogP4.55
Rot. Bonds5

About 4-[tert-butyl(dimethyl)silyl]oxy-N,N-diethylbenzamide

4-[tert-butyl(dimethyl)silyl]oxy-N,N-diethylbenzamide (PubChem CID 58586309) has the molecular formula C17H29NO2Si and a molecular weight of 307.51 g/mol. Its IUPAC name is 4-[tert-butyl(dimethyl)silyl]oxy-N,N-diethylbenzamide.

Molecular Properties

Compound Name4-[tert-butyl(dimethyl)silyl]oxy-N,N-diethylbenzamide
PubChem CID58586309
Molecular FormulaC17H29NO2Si
Molecular Weight307.51 g/mol
Exact Mass307.20
IUPAC Name4-[tert-butyl(dimethyl)silyl]oxy-N,N-diethylbenzamide
SMILESCCN(CC)C(=O)c1ccc(O[Si](C)(C)C(C)(C)C)cc1
InChIInChI=1S/C17H29NO2Si/c1-8-18(9-2)16(19)14-10-12-15(13-11-14)20-21(6,7)17(3,4)5/h10-13H,8-9H2,1-7H3
InChIKeyCJPUCPOWMFGQAV-UHFFFAOYSA-N
XLogP4.55
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.51
LogP ≤ 54.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2,4-bis[[tert-butyl(dimethyl)silyl]oxy]-N,N-diethylbenzamide
CID 11419229
ethyl 4-[tert-butyl(dimethyl)silyl]oxybenzoate
CID 11289003
[4-[tert-butyl(dimethyl)silyl]oxyphenyl] N-ethylcarbamate
CID 69186234
[4-(diethylcarbamoyl)phenyl] acetate
CID 683590
1-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]prop-2-yn-1-one
CID 86037081
N,N-diethyl-4-(2-methoxyethoxy)benzamide
CID 17353475
N-ethyl-N-(2-hydroxy-2-methylpropyl)-4-[(2-methylpropan-2-yl)oxy]benzamide
CID 111859493
(E)-1-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]hex-4-en-1-one
CID 146163201
N,N-diethyl-4-(2-methylpropoxy)benzamide
CID 60635917
4-[bis(dimethylamino)phosphoryloxy]-N,N-diethylbenzamide
CID 14791031
4-[tert-butyl(dimethyl)silyl]oxy-N,N-diethyl-1,3-benzodioxole-5-carboxamide
CID 11013581
[4-(diethylcarbamoyl)phenyl] benzoate
CID 139836095

Frequently Asked Questions

What is the IUPAC name of 4-[tert-butyl(dimethyl)silyl]oxy-N,N-diethylbenzamide?
The IUPAC name of 4-[tert-butyl(dimethyl)silyl]oxy-N,N-diethylbenzamide (CID 58586309) is 4-[tert-butyl(dimethyl)silyl]oxy-N,N-diethylbenzamide.
What is the SMILES notation for 4-[tert-butyl(dimethyl)silyl]oxy-N,N-diethylbenzamide?
The canonical SMILES for 4-[tert-butyl(dimethyl)silyl]oxy-N,N-diethylbenzamide is CCN(CC)C(=O)c1ccc(O[Si](C)(C)C(C)(C)C)cc1.
What is the InChIKey of 4-[tert-butyl(dimethyl)silyl]oxy-N,N-diethylbenzamide?
The InChIKey is CJPUCPOWMFGQAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29NO2Si/c1-8-18(9-2)16(19)14-10-12-15(13-11-14)20-21(6,7)17(3,4)5/h10-13H,8-9H2,1-7H3.
What are the key properties of 4-[tert-butyl(dimethyl)silyl]oxy-N,N-diethylbenzamide?
4-[tert-butyl(dimethyl)silyl]oxy-N,N-diethylbenzamide has a molecular weight of 307.51 g/mol, XLogP of 4.55, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[tert-butyl(dimethyl)silyl]oxy-N,N-diethylbenzamide is sourced from PubChem (CID 58586309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).