N,N-diethyl-2-trimethylsilylbuta-2,3-dienamide

C11H21NOSi — CID 12656675

IUPACN,N-diethyl-2-trimethylsilylbuta-2,3-dienamide
SMILESC=C=C(C(=O)N(CC)CC)[Si](C)(C)C
InChIInChI=1S/C11H21NOSi/c1-7-10(14(4,5)6)11(13)12(8-2)9-3/h1,8-9H2,2-6H3
InChIKeyQLCCVYZTZPIKRA-UHFFFAOYSA-N
MW211.38 g/mol
LogP2.44
Rot. Bonds4

About N,N-diethyl-2-trimethylsilylbuta-2,3-dienamide

N,N-diethyl-2-trimethylsilylbuta-2,3-dienamide (PubChem CID 12656675) has the molecular formula C11H21NOSi and a molecular weight of 211.38 g/mol. Its IUPAC name is N,N-diethyl-2-trimethylsilylbuta-2,3-dienamide.

Molecular Properties

Compound NameN,N-diethyl-2-trimethylsilylbuta-2,3-dienamide
PubChem CID12656675
Molecular FormulaC11H21NOSi
Molecular Weight211.38 g/mol
Exact Mass211.14
IUPAC NameN,N-diethyl-2-trimethylsilylbuta-2,3-dienamide
SMILESC=C=C(C(=O)N(CC)CC)[Si](C)(C)C
InChIInChI=1S/C11H21NOSi/c1-7-10(14(4,5)6)11(13)12(8-2)9-3/h1,8-9H2,2-6H3
InChIKeyQLCCVYZTZPIKRA-UHFFFAOYSA-N
XLogP2.44
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.38
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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,N-diethyl-2-trimethylsilylbuta-2,3-dienamide?
The IUPAC name of N,N-diethyl-2-trimethylsilylbuta-2,3-dienamide (CID 12656675) is N,N-diethyl-2-trimethylsilylbuta-2,3-dienamide.
What is the SMILES notation for N,N-diethyl-2-trimethylsilylbuta-2,3-dienamide?
The canonical SMILES for N,N-diethyl-2-trimethylsilylbuta-2,3-dienamide is C=C=C(C(=O)N(CC)CC)[Si](C)(C)C.
What is the InChIKey of N,N-diethyl-2-trimethylsilylbuta-2,3-dienamide?
The InChIKey is QLCCVYZTZPIKRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NOSi/c1-7-10(14(4,5)6)11(13)12(8-2)9-3/h1,8-9H2,2-6H3.
What are the key properties of N,N-diethyl-2-trimethylsilylbuta-2,3-dienamide?
N,N-diethyl-2-trimethylsilylbuta-2,3-dienamide has a molecular weight of 211.38 g/mol, XLogP of 2.44, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-trimethylsilylbuta-2,3-dienamide is sourced from PubChem (CID 12656675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).