N,N-diethyl-3-trimethylsilylprop-1-yn-1-amine

C10H21NSi — CID 12563800

IUPACN,N-diethyl-3-trimethylsilylprop-1-yn-1-amine
SMILESCCN(C#CC[Si](C)(C)C)CC
InChIInChI=1S/C10H21NSi/c1-6-11(7-2)9-8-10-12(3,4)5/h6-7,10H2,1-5H3
InChIKeyVUBVYTUMMMGOTK-UHFFFAOYSA-N
MW183.37 g/mol
LogP2.63
Rot. Bonds3

About N,N-diethyl-3-trimethylsilylprop-1-yn-1-amine

N,N-diethyl-3-trimethylsilylprop-1-yn-1-amine (PubChem CID 12563800) has the molecular formula C10H21NSi and a molecular weight of 183.37 g/mol. Its IUPAC name is N,N-diethyl-3-trimethylsilylprop-1-yn-1-amine.

Molecular Properties

Compound NameN,N-diethyl-3-trimethylsilylprop-1-yn-1-amine
PubChem CID12563800
Molecular FormulaC10H21NSi
Molecular Weight183.37 g/mol
Exact Mass183.14
IUPAC NameN,N-diethyl-3-trimethylsilylprop-1-yn-1-amine
SMILESCCN(C#CC[Si](C)(C)C)CC
InChIInChI=1S/C10H21NSi/c1-6-11(7-2)9-8-10-12(3,4)5/h6-7,10H2,1-5H3
InChIKeyVUBVYTUMMMGOTK-UHFFFAOYSA-N
XLogP2.63
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.37
LogP ≤ 52.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-3-trimethylsilylprop-1-yn-1-amine?
The IUPAC name of N,N-diethyl-3-trimethylsilylprop-1-yn-1-amine (CID 12563800) is N,N-diethyl-3-trimethylsilylprop-1-yn-1-amine.
What is the SMILES notation for N,N-diethyl-3-trimethylsilylprop-1-yn-1-amine?
The canonical SMILES for N,N-diethyl-3-trimethylsilylprop-1-yn-1-amine is CCN(C#CC[Si](C)(C)C)CC.
What is the InChIKey of N,N-diethyl-3-trimethylsilylprop-1-yn-1-amine?
The InChIKey is VUBVYTUMMMGOTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NSi/c1-6-11(7-2)9-8-10-12(3,4)5/h6-7,10H2,1-5H3.
What are the key properties of N,N-diethyl-3-trimethylsilylprop-1-yn-1-amine?
N,N-diethyl-3-trimethylsilylprop-1-yn-1-amine has a molecular weight of 183.37 g/mol, XLogP of 2.63, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-3-trimethylsilylprop-1-yn-1-amine is sourced from PubChem (CID 12563800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).