N-[3-[dimethoxy(phenyl)silyl]propyl]prop-2-enamide

C14H21NO3Si — CID 23152143

IUPACN-[3-[dimethoxy(phenyl)silyl]propyl]prop-2-enamide
SMILESC=CC(=O)NCCC[Si](OC)(OC)c1ccccc1
InChIInChI=1S/C14H21NO3Si/c1-4-14(16)15-11-8-12-19(17-2,18-3)13-9-6-5-7-10-13/h4-7,9-10H,1,8,11-12H2,2-3H3,(H,15,16)
InChIKeyFONFYEJBRZLLIX-UHFFFAOYSA-N
MW279.41 g/mol
LogP1.32
Rot. Bonds8

About N-[3-[dimethoxy(phenyl)silyl]propyl]prop-2-enamide

N-[3-[dimethoxy(phenyl)silyl]propyl]prop-2-enamide (PubChem CID 23152143) has the molecular formula C14H21NO3Si and a molecular weight of 279.41 g/mol. Its IUPAC name is N-[3-[dimethoxy(phenyl)silyl]propyl]prop-2-enamide.

Molecular Properties

Compound NameN-[3-[dimethoxy(phenyl)silyl]propyl]prop-2-enamide
PubChem CID23152143
Molecular FormulaC14H21NO3Si
Molecular Weight279.41 g/mol
Exact Mass279.13
IUPAC NameN-[3-[dimethoxy(phenyl)silyl]propyl]prop-2-enamide
SMILESC=CC(=O)NCCC[Si](OC)(OC)c1ccccc1
InChIInChI=1S/C14H21NO3Si/c1-4-14(16)15-11-8-12-19(17-2,18-3)13-9-6-5-7-10-13/h4-7,9-10H,1,8,11-12H2,2-3H3,(H,15,16)
InChIKeyFONFYEJBRZLLIX-UHFFFAOYSA-N
XLogP1.32
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.41
LogP ≤ 51.32
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': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[3-[dimethoxy(phenyl)silyl]propyl]prop-2-enamide?
The IUPAC name of N-[3-[dimethoxy(phenyl)silyl]propyl]prop-2-enamide (CID 23152143) is N-[3-[dimethoxy(phenyl)silyl]propyl]prop-2-enamide.
What is the SMILES notation for N-[3-[dimethoxy(phenyl)silyl]propyl]prop-2-enamide?
The canonical SMILES for N-[3-[dimethoxy(phenyl)silyl]propyl]prop-2-enamide is C=CC(=O)NCCC[Si](OC)(OC)c1ccccc1.
What is the InChIKey of N-[3-[dimethoxy(phenyl)silyl]propyl]prop-2-enamide?
The InChIKey is FONFYEJBRZLLIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO3Si/c1-4-14(16)15-11-8-12-19(17-2,18-3)13-9-6-5-7-10-13/h4-7,9-10H,1,8,11-12H2,2-3H3,(H,15,16).
What are the key properties of N-[3-[dimethoxy(phenyl)silyl]propyl]prop-2-enamide?
N-[3-[dimethoxy(phenyl)silyl]propyl]prop-2-enamide has a molecular weight of 279.41 g/mol, XLogP of 1.32, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[dimethoxy(phenyl)silyl]propyl]prop-2-enamide is sourced from PubChem (CID 23152143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).