methyl 2-[3-[[3-[(2-methoxy-2-oxoacetyl)amino]propyl-dimethylsilyl]oxy-dimethylsilyl]propylamino]-2-oxoacetate

C16H32N2O7Si2 — CID 175696779

IUPACmethyl 2-[3-[[3-[(2-methoxy-2-oxoacetyl)amino]propyl-dimethylsilyl]oxy-dimethylsilyl]propylamino]-2-oxoacetate
SMILESCOC(=O)C(=O)NCCC[Si](C)(C)O[Si](C)(C)CCCNC(=O)C(=O)OC
InChIInChI=1S/C16H32N2O7Si2/c1-23-15(21)13(19)17-9-7-11-26(3,4)25-27(5,6)12-8-10-18-14(20)16(22)24-2/h7-12H2,1-6H3,(H,17,19)(H,18,20)
InChIKeyGLWQPGADPJMVGO-UHFFFAOYSA-N
MW420.61 g/mol
LogP0.77
Rot. Bonds10

About methyl 2-[3-[[3-[(2-methoxy-2-oxoacetyl)amino]propyl-dimethylsilyl]oxy-dimethylsilyl]propylamino]-2-oxoacetate

methyl 2-[3-[[3-[(2-methoxy-2-oxoacetyl)amino]propyl-dimethylsilyl]oxy-dimethylsilyl]propylamino]-2-oxoacetate (PubChem CID 175696779) has the molecular formula C16H32N2O7Si2 and a molecular weight of 420.61 g/mol. Its IUPAC name is methyl 2-[3-[[3-[(2-methoxy-2-oxoacetyl)amino]propyl-dimethylsilyl]oxy-dimethylsilyl]propylamino]-2-oxoacetate.

Molecular Properties

Compound Namemethyl 2-[3-[[3-[(2-methoxy-2-oxoacetyl)amino]propyl-dimethylsilyl]oxy-dimethylsilyl]propylamino]-2-oxoacetate
PubChem CID175696779
Molecular FormulaC16H32N2O7Si2
Molecular Weight420.61 g/mol
Exact Mass420.17
IUPAC Namemethyl 2-[3-[[3-[(2-methoxy-2-oxoacetyl)amino]propyl-dimethylsilyl]oxy-dimethylsilyl]propylamino]-2-oxoacetate
SMILESCOC(=O)C(=O)NCCC[Si](C)(C)O[Si](C)(C)CCCNC(=O)C(=O)OC
InChIInChI=1S/C16H32N2O7Si2/c1-23-15(21)13(19)17-9-7-11-26(3,4)25-27(5,6)12-8-10-18-14(20)16(22)24-2/h7-12H2,1-6H3,(H,17,19)(H,18,20)
InChIKeyGLWQPGADPJMVGO-UHFFFAOYSA-N
XLogP0.77
TPSA120.03 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds10
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500420.61
LogP ≤ 50.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

Analyze methyl 2-[3-[[3-[(2-methoxy-2-oxoacetyl)amino]propyl-dimethylsilyl]oxy-dimethylsilyl]propylamino]-2-oxoacetate with MolForge

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Related Compounds

methyl 2-[3-[[[[[[[[[[[[3-[(2-methoxy-2-oxoacetyl)amino]propyl-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propylamino]-2-oxoacetate
CID 175696771
methyl 2-[3-[ethoxy(dimethyl)silyl]propylamino]-2-oxoacetate
CID 175715117
methyl 2-[4-[(2-methoxy-2-oxoacetyl)amino]butylamino]-2-oxoacetate
CID 118608572
methyl 2-(3-hydroxypropylamino)-2-oxoacetate
CID 45082405
3-[[4-(carbamoylamino)butyl-dimethylsilyl]oxy-dimethylsilyl]propylurea
CID 59079127
methyl 2-[6-[(2-methoxy-2-oxoacetyl)amino]hexylamino]-2-oxoacetate;N-octyl-N'-[6-[[2-(octylamino)-2-oxoacetyl]amino]hexyl]oxamide
CID 158140787
N-[3-[[[3-acetamidopropyl(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propyl]acetamide
CID 153418128
4-[3-[[3-(3-carboxypropanoylamino)propyl-dimethylsilyl]oxy-dimethylsilyl]propylamino]-4-oxobutanoic acid
CID 170942066
(E)-4-[3-[[3-[[(E)-3-carboxyprop-2-enoyl]amino]propyl-dimethylsilyl]oxy-dimethylsilyl]propylamino]-4-oxobut-2-enoic acid
CID 20725140
N,N'-bis(3-trimethoxysilylpropyl)oxamide
CID 122383973
2,4-bis[3-[methoxy(dimethyl)silyl]propylcarbamoyl]cyclobutane-1,3-dicarboxylic acid
CID 174032206
2-[3-[[dimethyl-[3-(2-prop-2-enoyloxyethoxycarbonylamino)propyl]silyl]oxy-dimethylsilyl]propylcarbamoyloxy]ethyl prop-2-enoate
CID 140879603

Frequently Asked Questions

What is the IUPAC name of methyl 2-[3-[[3-[(2-methoxy-2-oxoacetyl)amino]propyl-dimethylsilyl]oxy-dimethylsilyl]propylamino]-2-oxoacetate?
The IUPAC name of methyl 2-[3-[[3-[(2-methoxy-2-oxoacetyl)amino]propyl-dimethylsilyl]oxy-dimethylsilyl]propylamino]-2-oxoacetate (CID 175696779) is methyl 2-[3-[[3-[(2-methoxy-2-oxoacetyl)amino]propyl-dimethylsilyl]oxy-dimethylsilyl]propylamino]-2-oxoacetate.
What is the SMILES notation for methyl 2-[3-[[3-[(2-methoxy-2-oxoacetyl)amino]propyl-dimethylsilyl]oxy-dimethylsilyl]propylamino]-2-oxoacetate?
The canonical SMILES for methyl 2-[3-[[3-[(2-methoxy-2-oxoacetyl)amino]propyl-dimethylsilyl]oxy-dimethylsilyl]propylamino]-2-oxoacetate is COC(=O)C(=O)NCCC[Si](C)(C)O[Si](C)(C)CCCNC(=O)C(=O)OC.
What is the InChIKey of methyl 2-[3-[[3-[(2-methoxy-2-oxoacetyl)amino]propyl-dimethylsilyl]oxy-dimethylsilyl]propylamino]-2-oxoacetate?
The InChIKey is GLWQPGADPJMVGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O7Si2/c1-23-15(21)13(19)17-9-7-11-26(3,4)25-27(5,6)12-8-10-18-14(20)16(22)24-2/h7-12H2,1-6H3,(H,17,19)(H,18,20).
What are the key properties of methyl 2-[3-[[3-[(2-methoxy-2-oxoacetyl)amino]propyl-dimethylsilyl]oxy-dimethylsilyl]propylamino]-2-oxoacetate?
methyl 2-[3-[[3-[(2-methoxy-2-oxoacetyl)amino]propyl-dimethylsilyl]oxy-dimethylsilyl]propylamino]-2-oxoacetate has a molecular weight of 420.61 g/mol, XLogP of 0.77, 10 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[3-[[3-[(2-methoxy-2-oxoacetyl)amino]propyl-dimethylsilyl]oxy-dimethylsilyl]propylamino]-2-oxoacetate is sourced from PubChem (CID 175696779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).