N-[3-[dimethoxy(methyl)silyl]propyl]-2-methyl-N-(2-methylprop-2-enoyl)prop-2-enamide

C14H25NO4Si — CID 19758116

IUPACN-[3-[dimethoxy(methyl)silyl]propyl]-2-methyl-N-(2-methylprop-2-enoyl)prop-2-enamide
SMILESC=C(C)C(=O)N(CCC[Si](C)(OC)OC)C(=O)C(=C)C
InChIInChI=1S/C14H25NO4Si/c1-11(2)13(16)15(14(17)12(3)4)9-8-10-20(7,18-5)19-6/h1,3,8-10H2,2,4-7H3
InChIKeyZYXJRZFYDQXUNG-UHFFFAOYSA-N
MW299.44 g/mol
LogP2.25
Rot. Bonds8

About N-[3-[dimethoxy(methyl)silyl]propyl]-2-methyl-N-(2-methylprop-2-enoyl)prop-2-enamide

N-[3-[dimethoxy(methyl)silyl]propyl]-2-methyl-N-(2-methylprop-2-enoyl)prop-2-enamide (PubChem CID 19758116) has the molecular formula C14H25NO4Si and a molecular weight of 299.44 g/mol. Its IUPAC name is N-[3-[dimethoxy(methyl)silyl]propyl]-2-methyl-N-(2-methylprop-2-enoyl)prop-2-enamide.

Molecular Properties

Compound NameN-[3-[dimethoxy(methyl)silyl]propyl]-2-methyl-N-(2-methylprop-2-enoyl)prop-2-enamide
PubChem CID19758116
Molecular FormulaC14H25NO4Si
Molecular Weight299.44 g/mol
Exact Mass299.16
IUPAC NameN-[3-[dimethoxy(methyl)silyl]propyl]-2-methyl-N-(2-methylprop-2-enoyl)prop-2-enamide
SMILESC=C(C)C(=O)N(CCC[Si](C)(OC)OC)C(=O)C(=C)C
InChIInChI=1S/C14H25NO4Si/c1-11(2)13(16)15(14(17)12(3)4)9-8-10-20(7,18-5)19-6/h1,3,8-10H2,2,4-7H3
InChIKeyZYXJRZFYDQXUNG-UHFFFAOYSA-N
XLogP2.25
TPSA55.84 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.44
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'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(methyl)silyl]propyl]-2-methyl-N-(2-methylprop-2-enoyl)prop-2-enamide?
The IUPAC name of N-[3-[dimethoxy(methyl)silyl]propyl]-2-methyl-N-(2-methylprop-2-enoyl)prop-2-enamide (CID 19758116) is N-[3-[dimethoxy(methyl)silyl]propyl]-2-methyl-N-(2-methylprop-2-enoyl)prop-2-enamide.
What is the SMILES notation for N-[3-[dimethoxy(methyl)silyl]propyl]-2-methyl-N-(2-methylprop-2-enoyl)prop-2-enamide?
The canonical SMILES for N-[3-[dimethoxy(methyl)silyl]propyl]-2-methyl-N-(2-methylprop-2-enoyl)prop-2-enamide is C=C(C)C(=O)N(CCC[Si](C)(OC)OC)C(=O)C(=C)C.
What is the InChIKey of N-[3-[dimethoxy(methyl)silyl]propyl]-2-methyl-N-(2-methylprop-2-enoyl)prop-2-enamide?
The InChIKey is ZYXJRZFYDQXUNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO4Si/c1-11(2)13(16)15(14(17)12(3)4)9-8-10-20(7,18-5)19-6/h1,3,8-10H2,2,4-7H3.
What are the key properties of N-[3-[dimethoxy(methyl)silyl]propyl]-2-methyl-N-(2-methylprop-2-enoyl)prop-2-enamide?
N-[3-[dimethoxy(methyl)silyl]propyl]-2-methyl-N-(2-methylprop-2-enoyl)prop-2-enamide has a molecular weight of 299.44 g/mol, XLogP of 2.25, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[dimethoxy(methyl)silyl]propyl]-2-methyl-N-(2-methylprop-2-enoyl)prop-2-enamide is sourced from PubChem (CID 19758116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).