2-[ethyl(trimethylsilyl)amino]acetonitrile

C7H16N2Si — CID 87072278

IUPAC2-[ethyl(trimethylsilyl)amino]acetonitrile
SMILESCCN(CC#N)[Si](C)(C)C
InChIInChI=1S/C7H16N2Si/c1-5-9(7-6-8)10(2,3)4/h5,7H2,1-4H3
InChIKeyQCIJUNMLFNLAOP-UHFFFAOYSA-N
MW156.30 g/mol
LogP1.67
Rot. Bonds3

About 2-[ethyl(trimethylsilyl)amino]acetonitrile

2-[ethyl(trimethylsilyl)amino]acetonitrile (PubChem CID 87072278) has the molecular formula C7H16N2Si and a molecular weight of 156.30 g/mol. Its IUPAC name is 2-[ethyl(trimethylsilyl)amino]acetonitrile.

Molecular Properties

Compound Name2-[ethyl(trimethylsilyl)amino]acetonitrile
PubChem CID87072278
Molecular FormulaC7H16N2Si
Molecular Weight156.30 g/mol
Exact Mass156.11
IUPAC Name2-[ethyl(trimethylsilyl)amino]acetonitrile
SMILESCCN(CC#N)[Si](C)(C)C
InChIInChI=1S/C7H16N2Si/c1-5-9(7-6-8)10(2,3)4/h5,7H2,1-4H3
InChIKeyQCIJUNMLFNLAOP-UHFFFAOYSA-N
XLogP1.67
TPSA27.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.30
LogP ≤ 51.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[ethyl(trimethylsilyl)amino]acetonitrile?
The IUPAC name of 2-[ethyl(trimethylsilyl)amino]acetonitrile (CID 87072278) is 2-[ethyl(trimethylsilyl)amino]acetonitrile.
What is the SMILES notation for 2-[ethyl(trimethylsilyl)amino]acetonitrile?
The canonical SMILES for 2-[ethyl(trimethylsilyl)amino]acetonitrile is CCN(CC#N)[Si](C)(C)C.
What is the InChIKey of 2-[ethyl(trimethylsilyl)amino]acetonitrile?
The InChIKey is QCIJUNMLFNLAOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2Si/c1-5-9(7-6-8)10(2,3)4/h5,7H2,1-4H3.
What are the key properties of 2-[ethyl(trimethylsilyl)amino]acetonitrile?
2-[ethyl(trimethylsilyl)amino]acetonitrile has a molecular weight of 156.30 g/mol, XLogP of 1.67, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl(trimethylsilyl)amino]acetonitrile is sourced from PubChem (CID 87072278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).