4-[tert-butyl(diphenyl)silyl]oxy-1-morpholin-4-ylbutan-1-one

C24H33NO3Si — CID 11200741

IUPAC4-[tert-butyl(diphenyl)silyl]oxy-1-morpholin-4-ylbutan-1-one
SMILESCC(C)(C)[Si](OCCCC(=O)N1CCOCC1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C24H33NO3Si/c1-24(2,3)29(21-11-6-4-7-12-21,22-13-8-5-9-14-22)28-18-10-15-23(26)25-16-19-27-20-17-25/h4-9,11-14H,10,15-20H2,1-3H3
InChIKeyMRIXKETUVDJJRS-UHFFFAOYSA-N
MW411.62 g/mol
LogP3.20
Rot. Bonds7

About 4-[tert-butyl(diphenyl)silyl]oxy-1-morpholin-4-ylbutan-1-one

4-[tert-butyl(diphenyl)silyl]oxy-1-morpholin-4-ylbutan-1-one (PubChem CID 11200741) has the molecular formula C24H33NO3Si and a molecular weight of 411.62 g/mol. Its IUPAC name is 4-[tert-butyl(diphenyl)silyl]oxy-1-morpholin-4-ylbutan-1-one.

Molecular Properties

Compound Name4-[tert-butyl(diphenyl)silyl]oxy-1-morpholin-4-ylbutan-1-one
PubChem CID11200741
Molecular FormulaC24H33NO3Si
Molecular Weight411.62 g/mol
Exact Mass411.22
IUPAC Name4-[tert-butyl(diphenyl)silyl]oxy-1-morpholin-4-ylbutan-1-one
SMILESCC(C)(C)[Si](OCCCC(=O)N1CCOCC1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C24H33NO3Si/c1-24(2,3)29(21-11-6-4-7-12-21,22-13-8-5-9-14-22)28-18-10-15-23(26)25-16-19-27-20-17-25/h4-9,11-14H,10,15-20H2,1-3H3
InChIKeyMRIXKETUVDJJRS-UHFFFAOYSA-N
XLogP3.20
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500411.62
LogP ≤ 53.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-[Dimethyl(phenyl)silyl]-2,2-difluoro-1-morpholin-4-ylbutan-1-one
CID 177849979
[1-[2-[tert-butyl(diphenyl)silyl]oxyethyl]cyclohexa-2,5-dien-1-yl]-(3,6-dihydro-2H-pyridin-1-yl)methanone
CID 134887002
3-((Tert-butyldiphenylsilyl)oxy)-1-(2-methylpiperidin-1-yl)propan-1-one
CID 135391106
2-[4-({[tert-Butyl(diphenyl)silyl]oxy}methyl)piperidin-1-yl]-2-oxoethyl acetate
CID 59161011
tert-butyl N-butanoyl-N-[2-[tert-butyl(diphenyl)silyl]oxyethyl]carbamate
CID 70863180
(+/-)-Tert-butyl 5-((tert-butyldiphenylsilyl)oxy)-2-oxopiperidine-1-carboxylate
CID 131747989
5-[Tert-butyl(diphenyl)silyl]oxypiperidin-2-one
CID 139271638
tert-butyl (3R)-3-[tert-butyl(diphenyl)silyl]oxypiperidine-1-carboxylate
CID 140918784
5-[Tert-butyl(diphenyl)silyl]oxy-1-methylpiperidin-2-one
CID 140943531
5-[Tert-butyl(diphenyl)silyl]oxy-1-ethylpiperidin-2-one
CID 140943548
5-[Tert-butyl(diphenyl)silyl]oxy-2-oxopiperidine-1-carboxylic acid
CID 141439625
Methyl 4-[2-[tert-butyl(diphenyl)silyl]oxyethyl-ethylamino]butanoate
CID 167364784

Frequently Asked Questions

What is the IUPAC name of 4-[tert-butyl(diphenyl)silyl]oxy-1-morpholin-4-ylbutan-1-one?
The IUPAC name of 4-[tert-butyl(diphenyl)silyl]oxy-1-morpholin-4-ylbutan-1-one (CID 11200741) is 4-[tert-butyl(diphenyl)silyl]oxy-1-morpholin-4-ylbutan-1-one.
What is the SMILES notation for 4-[tert-butyl(diphenyl)silyl]oxy-1-morpholin-4-ylbutan-1-one?
The canonical SMILES for 4-[tert-butyl(diphenyl)silyl]oxy-1-morpholin-4-ylbutan-1-one is CC(C)(C)[Si](OCCCC(=O)N1CCOCC1)(c1ccccc1)c1ccccc1.
What is the InChIKey of 4-[tert-butyl(diphenyl)silyl]oxy-1-morpholin-4-ylbutan-1-one?
The InChIKey is MRIXKETUVDJJRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H33NO3Si/c1-24(2,3)29(21-11-6-4-7-12-21,22-13-8-5-9-14-22)28-18-10-15-23(26)25-16-19-27-20-17-25/h4-9,11-14H,10,15-20H2,1-3H3.
What are the key properties of 4-[tert-butyl(diphenyl)silyl]oxy-1-morpholin-4-ylbutan-1-one?
4-[tert-butyl(diphenyl)silyl]oxy-1-morpholin-4-ylbutan-1-one has a molecular weight of 411.62 g/mol, XLogP of 3.20, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[tert-butyl(diphenyl)silyl]oxy-1-morpholin-4-ylbutan-1-one is sourced from PubChem (CID 11200741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).