1-amino-5-[diethoxy(methyl)silyl]-3-methoxypentan-2-one

C11H25NO4Si — CID 140738465

IUPAC1-amino-5-[diethoxy(methyl)silyl]-3-methoxypentan-2-one
SMILESCCO[Si](C)(CCC(OC)C(=O)CN)OCC
InChIInChI=1S/C11H25NO4Si/c1-5-15-17(4,16-6-2)8-7-11(14-3)10(13)9-12/h11H,5-9,12H2,1-4H3
InChIKeyOZPRNTUSUUYXIQ-UHFFFAOYSA-N
MW263.41 g/mol
LogP1.06
Rot. Bonds10

About 1-amino-5-[diethoxy(methyl)silyl]-3-methoxypentan-2-one

1-amino-5-[diethoxy(methyl)silyl]-3-methoxypentan-2-one (PubChem CID 140738465) has the molecular formula C11H25NO4Si and a molecular weight of 263.41 g/mol. Its IUPAC name is 1-amino-5-[diethoxy(methyl)silyl]-3-methoxypentan-2-one.

Molecular Properties

Compound Name1-amino-5-[diethoxy(methyl)silyl]-3-methoxypentan-2-one
PubChem CID140738465
Molecular FormulaC11H25NO4Si
Molecular Weight263.41 g/mol
Exact Mass263.16
IUPAC Name1-amino-5-[diethoxy(methyl)silyl]-3-methoxypentan-2-one
SMILESCCO[Si](C)(CCC(OC)C(=O)CN)OCC
InChIInChI=1S/C11H25NO4Si/c1-5-15-17(4,16-6-2)8-7-11(14-3)10(13)9-12/h11H,5-9,12H2,1-4H3
InChIKeyOZPRNTUSUUYXIQ-UHFFFAOYSA-N
XLogP1.06
TPSA70.78 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.41
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

7-[diethoxy(methyl)silyl]-5-hydroxyhept-2-en-4-one
CID 123376782
bis[3-[diethoxy(methyl)silyl]propyl] carbonate
CID 54561598
1,17-bis[diethoxy(methyl)silyl]-8,10-dimethylheptadecan-9-one
CID 87593412
methyl N-[3-[diethoxy(methyl)silyl]propyl]carbamate
CID 22065771
3-[diethoxy(methyl)silyl]propan-1-amine;tetramethyl silicate
CID 160657571
ethyl N-[4-[diethoxy(methyl)silyl]butyl]carbamate
CID 22065744
1-[diethoxy(methyl)silyl]-N-methylhexan-3-amine
CID 175202132
3-[diethoxy(methyl)silyl]propyl 2-methylprop-2-enoate;tetraethyl silicate
CID 87080022
ethyl 2-methoxybutanoate
CID 59767959
4-[dimethoxy(methyl)silyl]butan-2-amine
CID 22670886
(3S,4S)-1-amino-4-ethoxy-3-methylpentan-2-one
CID 89043198
3-[diethoxy(methyl)silyl]propyl pyridine-4-carboxylate
CID 68839365

Frequently Asked Questions

What is the IUPAC name of 1-amino-5-[diethoxy(methyl)silyl]-3-methoxypentan-2-one?
The IUPAC name of 1-amino-5-[diethoxy(methyl)silyl]-3-methoxypentan-2-one (CID 140738465) is 1-amino-5-[diethoxy(methyl)silyl]-3-methoxypentan-2-one.
What is the SMILES notation for 1-amino-5-[diethoxy(methyl)silyl]-3-methoxypentan-2-one?
The canonical SMILES for 1-amino-5-[diethoxy(methyl)silyl]-3-methoxypentan-2-one is CCO[Si](C)(CCC(OC)C(=O)CN)OCC.
What is the InChIKey of 1-amino-5-[diethoxy(methyl)silyl]-3-methoxypentan-2-one?
The InChIKey is OZPRNTUSUUYXIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO4Si/c1-5-15-17(4,16-6-2)8-7-11(14-3)10(13)9-12/h11H,5-9,12H2,1-4H3.
What are the key properties of 1-amino-5-[diethoxy(methyl)silyl]-3-methoxypentan-2-one?
1-amino-5-[diethoxy(methyl)silyl]-3-methoxypentan-2-one has a molecular weight of 263.41 g/mol, XLogP of 1.06, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-5-[diethoxy(methyl)silyl]-3-methoxypentan-2-one is sourced from PubChem (CID 140738465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).