2-methylidene-N-triethoxysilylpentanamide

C12H25NO4Si — CID 87640419

IUPAC2-methylidene-N-triethoxysilylpentanamide
SMILESC=C(CCC)C(=O)N[Si](OCC)(OCC)OCC
InChIInChI=1S/C12H25NO4Si/c1-6-10-11(5)12(14)13-18(15-7-2,16-8-3)17-9-4/h5-10H2,1-4H3,(H,13,14)
InChIKeyAUFPNIKZIJIZEI-UHFFFAOYSA-N
MW275.42 g/mol
LogP2.00
Rot. Bonds10

About 2-methylidene-N-triethoxysilylpentanamide

2-methylidene-N-triethoxysilylpentanamide (PubChem CID 87640419) has the molecular formula C12H25NO4Si and a molecular weight of 275.42 g/mol. Its IUPAC name is 2-methylidene-N-triethoxysilylpentanamide.

Molecular Properties

Compound Name2-methylidene-N-triethoxysilylpentanamide
PubChem CID87640419
Molecular FormulaC12H25NO4Si
Molecular Weight275.42 g/mol
Exact Mass275.16
IUPAC Name2-methylidene-N-triethoxysilylpentanamide
SMILESC=C(CCC)C(=O)N[Si](OCC)(OCC)OCC
InChIInChI=1S/C12H25NO4Si/c1-6-10-11(5)12(14)13-18(15-7-2,16-8-3)17-9-4/h5-10H2,1-4H3,(H,13,14)
InChIKeyAUFPNIKZIJIZEI-UHFFFAOYSA-N
XLogP2.00
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.42
LogP ≤ 52.00
H-Bond Donors ≤ 51
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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Related Compounds

N-hydroxy-2-methylidenepentanamide
CID 22256183
azane;N-methyl-2-methylidenepentanamide
CID 174850650
4,5-dimethylideneoctane
CID 13294231
4-methylideneheptan-3-one
CID 13485259
N-benzyl-2-methylidenepentanamide
CID 130015312
2-methylidenepentanoic acid;hydrate
CID 88770361
N-(ethoxy-methoxy-propylsilyl)-2-methylprop-2-enamide
CID 90008060
2-(2-methylidenepentanoylamino)ethyl hydrogen sulfate
CID 140572936
N,N-bis(methylamino)-2-methylidenepentanamide;hydrochloride
CID 141246092
N-chloro-2-methylidenehexanamide
CID 91615542
N-ethyl-2-methylidenehexanamide
CID 140513535
dimethylamino 2-methylidenepentanoate
CID 19885812

Frequently Asked Questions

What is the IUPAC name of 2-methylidene-N-triethoxysilylpentanamide?
The IUPAC name of 2-methylidene-N-triethoxysilylpentanamide (CID 87640419) is 2-methylidene-N-triethoxysilylpentanamide.
What is the SMILES notation for 2-methylidene-N-triethoxysilylpentanamide?
The canonical SMILES for 2-methylidene-N-triethoxysilylpentanamide is C=C(CCC)C(=O)N[Si](OCC)(OCC)OCC.
What is the InChIKey of 2-methylidene-N-triethoxysilylpentanamide?
The InChIKey is AUFPNIKZIJIZEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO4Si/c1-6-10-11(5)12(14)13-18(15-7-2,16-8-3)17-9-4/h5-10H2,1-4H3,(H,13,14).
What are the key properties of 2-methylidene-N-triethoxysilylpentanamide?
2-methylidene-N-triethoxysilylpentanamide has a molecular weight of 275.42 g/mol, XLogP of 2.00, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylidene-N-triethoxysilylpentanamide is sourced from PubChem (CID 87640419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).