N-[4-[tert-butyl(dimethyl)silyl]oxybutan-2-ylidene]hydroxylamine

C10H23NO2Si — CID 171665671

IUPACN-[4-[tert-butyl(dimethyl)silyl]oxybutan-2-ylidene]hydroxylamine
SMILESCC(CCO[Si](C)(C)C(C)(C)C)=NO
InChIInChI=1S/C10H23NO2Si/c1-9(11-12)7-8-13-14(5,6)10(2,3)4/h12H,7-8H2,1-6H3
InChIKeyCHTUXTZKLQCSEW-UHFFFAOYSA-N
MW217.38 g/mol
LogP3.25
Rot. Bonds4

About N-[4-[tert-butyl(dimethyl)silyl]oxybutan-2-ylidene]hydroxylamine

N-[4-[tert-butyl(dimethyl)silyl]oxybutan-2-ylidene]hydroxylamine (PubChem CID 171665671) has the molecular formula C10H23NO2Si and a molecular weight of 217.38 g/mol. Its IUPAC name is N-[4-[tert-butyl(dimethyl)silyl]oxybutan-2-ylidene]hydroxylamine.

Molecular Properties

Compound NameN-[4-[tert-butyl(dimethyl)silyl]oxybutan-2-ylidene]hydroxylamine
PubChem CID171665671
Molecular FormulaC10H23NO2Si
Molecular Weight217.38 g/mol
Exact Mass217.15
IUPAC NameN-[4-[tert-butyl(dimethyl)silyl]oxybutan-2-ylidene]hydroxylamine
SMILESCC(CCO[Si](C)(C)C(C)(C)C)=NO
InChIInChI=1S/C10H23NO2Si/c1-9(11-12)7-8-13-14(5,6)10(2,3)4/h12H,7-8H2,1-6H3
InChIKeyCHTUXTZKLQCSEW-UHFFFAOYSA-N
XLogP3.25
TPSA41.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.38
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

5-[tert-butyl(dimethyl)silyl]oxypentane-2,3-dione
CID 59850474
tert-butyl 3-[tert-butyl(dimethyl)silyl]oxypropanoate
CID 175251945
ethyl (1Z)-5-[tert-butyl(dimethyl)silyl]oxy-N-hydroxypentanimidothioate
CID 56834455
tert-butyl-[6-[tert-butyl(dimethyl)silyl]oxyhexoxy]-dimethylsilane
CID 6430202
tert-butyl-[5-[tert-butyl(dimethyl)silyl]oxypentoxy]-dimethylsilane
CID 529127
tert-butyl-[10-[tert-butyl(dimethyl)silyl]oxydecoxy]-dimethylsilane
CID 6430197
(Z)-6-[tert-butyl(dimethyl)silyl]oxy-3-methylhex-2-enal
CID 42611333
[(E)-3-bromo-5-[tert-butyl(dimethyl)silyl]oxypent-2-enoxy]-tert-butyl-dimethylsilane
CID 10811490
7-[tert-butyl(dimethyl)silyl]oxy-5,5-dimethylheptan-2-one
CID 99768812
O-[2-[tert-butyl(dimethyl)silyl]oxyethyl]hydroxylamine
CID 23132349
tert-butyl-[(E)-4-fluoropent-3-enoxy]-dimethylsilane
CID 59072765
2-[tert-butyl(dimethyl)silyl]oxy-N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]ethanamine
CID 11427595

Frequently Asked Questions

What is the IUPAC name of N-[4-[tert-butyl(dimethyl)silyl]oxybutan-2-ylidene]hydroxylamine?
The IUPAC name of N-[4-[tert-butyl(dimethyl)silyl]oxybutan-2-ylidene]hydroxylamine (CID 171665671) is N-[4-[tert-butyl(dimethyl)silyl]oxybutan-2-ylidene]hydroxylamine.
What is the SMILES notation for N-[4-[tert-butyl(dimethyl)silyl]oxybutan-2-ylidene]hydroxylamine?
The canonical SMILES for N-[4-[tert-butyl(dimethyl)silyl]oxybutan-2-ylidene]hydroxylamine is CC(CCO[Si](C)(C)C(C)(C)C)=NO.
What is the InChIKey of N-[4-[tert-butyl(dimethyl)silyl]oxybutan-2-ylidene]hydroxylamine?
The InChIKey is CHTUXTZKLQCSEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO2Si/c1-9(11-12)7-8-13-14(5,6)10(2,3)4/h12H,7-8H2,1-6H3.
What are the key properties of N-[4-[tert-butyl(dimethyl)silyl]oxybutan-2-ylidene]hydroxylamine?
N-[4-[tert-butyl(dimethyl)silyl]oxybutan-2-ylidene]hydroxylamine has a molecular weight of 217.38 g/mol, XLogP of 3.25, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[tert-butyl(dimethyl)silyl]oxybutan-2-ylidene]hydroxylamine is sourced from PubChem (CID 171665671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).