2-methyl-N-[4-silyl-4,4-bis(trimethylsilyloxy)butyl]prop-2-enamide

C14H33NO3Si3 — CID 173466192

IUPAC2-methyl-N-[4-silyl-4,4-bis(trimethylsilyloxy)butyl]prop-2-enamide
SMILESC=C(C)C(=O)NCCCC([SiH3])(O[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C14H33NO3Si3/c1-12(2)13(16)15-11-9-10-14(19,17-20(3,4)5)18-21(6,7)8/h1,9-11H2,2-8,19H3,(H,15,16)
InChIKeyRZPDSQXMPQSIKG-UHFFFAOYSA-N
MW347.68 g/mol
LogP2.18
Rot. Bonds9

About 2-methyl-N-[4-silyl-4,4-bis(trimethylsilyloxy)butyl]prop-2-enamide

2-methyl-N-[4-silyl-4,4-bis(trimethylsilyloxy)butyl]prop-2-enamide (PubChem CID 173466192) has the molecular formula C14H33NO3Si3 and a molecular weight of 347.68 g/mol. Its IUPAC name is 2-methyl-N-[4-silyl-4,4-bis(trimethylsilyloxy)butyl]prop-2-enamide.

Molecular Properties

Compound Name2-methyl-N-[4-silyl-4,4-bis(trimethylsilyloxy)butyl]prop-2-enamide
PubChem CID173466192
Molecular FormulaC14H33NO3Si3
Molecular Weight347.68 g/mol
Exact Mass347.18
IUPAC Name2-methyl-N-[4-silyl-4,4-bis(trimethylsilyloxy)butyl]prop-2-enamide
SMILESC=C(C)C(=O)NCCCC([SiH3])(O[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C14H33NO3Si3/c1-12(2)13(16)15-11-9-10-14(19,17-20(3,4)5)18-21(6,7)8/h1,9-11H2,2-8,19H3,(H,15,16)
InChIKeyRZPDSQXMPQSIKG-UHFFFAOYSA-N
XLogP2.18
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.68
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

2-methyl-N-[4-[[4-(2-methylprop-2-enoylamino)butyl-bis(trimethylsilyloxy)silyl]oxy-bis(trimethylsilyloxy)silyl]butyl]prop-2-enamide
CID 87119608
N-[8-[hydroxy(dimethyl)silyl]octyl]-2-methylprop-2-enamide
CID 162481107
N-(3-methoxysilylpropyl)-2-methylprop-2-enamide
CID 123275460
2-methyl-N-(6-triethoxysilylhexyl)prop-2-enamide
CID 58330356
N-[8-[diethoxy(methyl)silyl]octyl]-2-methylprop-2-enamide
CID 169083674
N-(3-dimethylarsanylpropyl)-2-methylprop-2-enamide
CID 87191392
2-methyl-N-[3-[3-[3-(3-methylbuta-1,3-dien-2-ylamino)propylamino]buta-1,3-dien-2-ylamino]propyl]prop-2-enamide
CID 166886440
N-(3-aminopropyl)-2-methylprop-2-enamide
CID 158225145
N-(3-bromopropyl)-2-methylprop-2-enamide
CID 86134938
2-methyl-N-[3-(2-methylprop-2-enoylamino)propyl]butanamide
CID 59773657
N-[2-[methoxy(dimethyl)silyl]ethyl]-2-methylprop-2-enamide
CID 22282767
N-[3-[dimethyl(2-trimethylsilyloxysilylethyl)silyl]oxysilylpropyl]-2-methylprop-2-enamide
CID 123712703

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[4-silyl-4,4-bis(trimethylsilyloxy)butyl]prop-2-enamide?
The IUPAC name of 2-methyl-N-[4-silyl-4,4-bis(trimethylsilyloxy)butyl]prop-2-enamide (CID 173466192) is 2-methyl-N-[4-silyl-4,4-bis(trimethylsilyloxy)butyl]prop-2-enamide.
What is the SMILES notation for 2-methyl-N-[4-silyl-4,4-bis(trimethylsilyloxy)butyl]prop-2-enamide?
The canonical SMILES for 2-methyl-N-[4-silyl-4,4-bis(trimethylsilyloxy)butyl]prop-2-enamide is C=C(C)C(=O)NCCCC([SiH3])(O[Si](C)(C)C)O[Si](C)(C)C.
What is the InChIKey of 2-methyl-N-[4-silyl-4,4-bis(trimethylsilyloxy)butyl]prop-2-enamide?
The InChIKey is RZPDSQXMPQSIKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H33NO3Si3/c1-12(2)13(16)15-11-9-10-14(19,17-20(3,4)5)18-21(6,7)8/h1,9-11H2,2-8,19H3,(H,15,16).
What are the key properties of 2-methyl-N-[4-silyl-4,4-bis(trimethylsilyloxy)butyl]prop-2-enamide?
2-methyl-N-[4-silyl-4,4-bis(trimethylsilyloxy)butyl]prop-2-enamide has a molecular weight of 347.68 g/mol, XLogP of 2.18, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[4-silyl-4,4-bis(trimethylsilyloxy)butyl]prop-2-enamide is sourced from PubChem (CID 173466192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).