N,3-dimethyl-2-silylbut-3-enamide;N-methylacetamide

C9H20N2O2Si — CID 173370095

IUPACN,3-dimethyl-2-silylbut-3-enamide;N-methylacetamide
SMILESC=C(C)C([SiH3])C(=O)NC.CNC(C)=O
InChIInChI=1S/C6H13NOSi.C3H7NO/c1-4(2)5(9)6(8)7-3;1-3(5)4-2/h5H,1H2,2-3,9H3,(H,7,8);1-2H3,(H,4,5)
InChIKeyCKJDISAFPJXGJV-UHFFFAOYSA-N
MW216.36 g/mol
LogP-0.79
Rot. Bonds2

About N,3-dimethyl-2-silylbut-3-enamide;N-methylacetamide

N,3-dimethyl-2-silylbut-3-enamide;N-methylacetamide (PubChem CID 173370095) has the molecular formula C9H20N2O2Si and a molecular weight of 216.36 g/mol. Its IUPAC name is N,3-dimethyl-2-silylbut-3-enamide;N-methylacetamide.

Molecular Properties

Compound NameN,3-dimethyl-2-silylbut-3-enamide;N-methylacetamide
PubChem CID173370095
Molecular FormulaC9H20N2O2Si
Molecular Weight216.36 g/mol
Exact Mass216.13
IUPAC NameN,3-dimethyl-2-silylbut-3-enamide;N-methylacetamide
SMILESC=C(C)C([SiH3])C(=O)NC.CNC(C)=O
InChIInChI=1S/C6H13NOSi.C3H7NO/c1-4(2)5(9)6(8)7-3;1-3(5)4-2/h5H,1H2,2-3,9H3,(H,7,8);1-2H3,(H,4,5)
InChIKeyCKJDISAFPJXGJV-UHFFFAOYSA-N
XLogP-0.79
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.36
LogP ≤ 5-0.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N,3-dimethyl-2-silylbut-3-enamide;N-methylacetamide?
The IUPAC name of N,3-dimethyl-2-silylbut-3-enamide;N-methylacetamide (CID 173370095) is N,3-dimethyl-2-silylbut-3-enamide;N-methylacetamide.
What is the SMILES notation for N,3-dimethyl-2-silylbut-3-enamide;N-methylacetamide?
The canonical SMILES for N,3-dimethyl-2-silylbut-3-enamide;N-methylacetamide is C=C(C)C([SiH3])C(=O)NC.CNC(C)=O.
What is the InChIKey of N,3-dimethyl-2-silylbut-3-enamide;N-methylacetamide?
The InChIKey is CKJDISAFPJXGJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NOSi.C3H7NO/c1-4(2)5(9)6(8)7-3;1-3(5)4-2/h5H,1H2,2-3,9H3,(H,7,8);1-2H3,(H,4,5).
What are the key properties of N,3-dimethyl-2-silylbut-3-enamide;N-methylacetamide?
N,3-dimethyl-2-silylbut-3-enamide;N-methylacetamide has a molecular weight of 216.36 g/mol, XLogP of -0.79, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-dimethyl-2-silylbut-3-enamide;N-methylacetamide is sourced from PubChem (CID 173370095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).