trimethyl-(3-methyl-4-pyrrolidin-1-ylbuta-1,2-dienyl)silane

C12H23NSi — CID 134983047

IUPACtrimethyl-(3-methyl-4-pyrrolidin-1-ylbuta-1,2-dienyl)silane
SMILESCC(=C=C[Si](C)(C)C)CN1CCCC1
InChIInChI=1S/C12H23NSi/c1-12(7-10-14(2,3)4)11-13-8-5-6-9-13/h10H,5-6,8-9,11H2,1-4H3
InChIKeyPFTTWNFKRBWXGT-UHFFFAOYSA-N
MW209.41 g/mol
LogP3.06
Rot. Bonds3

About trimethyl-(3-methyl-4-pyrrolidin-1-ylbuta-1,2-dienyl)silane

trimethyl-(3-methyl-4-pyrrolidin-1-ylbuta-1,2-dienyl)silane (PubChem CID 134983047) has the molecular formula C12H23NSi and a molecular weight of 209.41 g/mol. Its IUPAC name is trimethyl-(3-methyl-4-pyrrolidin-1-ylbuta-1,2-dienyl)silane.

Molecular Properties

Compound Nametrimethyl-(3-methyl-4-pyrrolidin-1-ylbuta-1,2-dienyl)silane
PubChem CID134983047
Molecular FormulaC12H23NSi
Molecular Weight209.41 g/mol
Exact Mass209.16
IUPAC Nametrimethyl-(3-methyl-4-pyrrolidin-1-ylbuta-1,2-dienyl)silane
SMILESCC(=C=C[Si](C)(C)C)CN1CCCC1
InChIInChI=1S/C12H23NSi/c1-12(7-10-14(2,3)4)11-13-8-5-6-9-13/h10H,5-6,8-9,11H2,1-4H3
InChIKeyPFTTWNFKRBWXGT-UHFFFAOYSA-N
XLogP3.06
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.41
LogP ≤ 53.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of trimethyl-(3-methyl-4-pyrrolidin-1-ylbuta-1,2-dienyl)silane?
The IUPAC name of trimethyl-(3-methyl-4-pyrrolidin-1-ylbuta-1,2-dienyl)silane (CID 134983047) is trimethyl-(3-methyl-4-pyrrolidin-1-ylbuta-1,2-dienyl)silane.
What is the SMILES notation for trimethyl-(3-methyl-4-pyrrolidin-1-ylbuta-1,2-dienyl)silane?
The canonical SMILES for trimethyl-(3-methyl-4-pyrrolidin-1-ylbuta-1,2-dienyl)silane is CC(=C=C[Si](C)(C)C)CN1CCCC1.
What is the InChIKey of trimethyl-(3-methyl-4-pyrrolidin-1-ylbuta-1,2-dienyl)silane?
The InChIKey is PFTTWNFKRBWXGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NSi/c1-12(7-10-14(2,3)4)11-13-8-5-6-9-13/h10H,5-6,8-9,11H2,1-4H3.
What are the key properties of trimethyl-(3-methyl-4-pyrrolidin-1-ylbuta-1,2-dienyl)silane?
trimethyl-(3-methyl-4-pyrrolidin-1-ylbuta-1,2-dienyl)silane has a molecular weight of 209.41 g/mol, XLogP of 3.06, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-(3-methyl-4-pyrrolidin-1-ylbuta-1,2-dienyl)silane is sourced from PubChem (CID 134983047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).