6-ethyl-2-methyloxasilinane-2-carbonitrile

C8H15NOSi — CID 18974160

IUPAC6-ethyl-2-methyloxasilinane-2-carbonitrile
SMILESCCC1CCC[Si](C)(C#N)O1
InChIInChI=1S/C8H15NOSi/c1-3-8-5-4-6-11(2,7-9)10-8/h8H,3-6H2,1-2H3
InChIKeyLYPHEUQSPWUSKT-UHFFFAOYSA-N
MW169.30 g/mol
LogP2.21
Rot. Bonds1

About 6-ethyl-2-methyloxasilinane-2-carbonitrile

6-ethyl-2-methyloxasilinane-2-carbonitrile (PubChem CID 18974160) has the molecular formula C8H15NOSi and a molecular weight of 169.30 g/mol. Its IUPAC name is 6-ethyl-2-methyloxasilinane-2-carbonitrile.

Molecular Properties

Compound Name6-ethyl-2-methyloxasilinane-2-carbonitrile
PubChem CID18974160
Molecular FormulaC8H15NOSi
Molecular Weight169.30 g/mol
Exact Mass169.09
IUPAC Name6-ethyl-2-methyloxasilinane-2-carbonitrile
SMILESCCC1CCC[Si](C)(C#N)O1
InChIInChI=1S/C8H15NOSi/c1-3-8-5-4-6-11(2,7-9)10-8/h8H,3-6H2,1-2H3
InChIKeyLYPHEUQSPWUSKT-UHFFFAOYSA-N
XLogP2.21
TPSA33.02 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.30
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 6-ethyl-2-methyloxasilinane-2-carbonitrile?
The IUPAC name of 6-ethyl-2-methyloxasilinane-2-carbonitrile (CID 18974160) is 6-ethyl-2-methyloxasilinane-2-carbonitrile.
What is the SMILES notation for 6-ethyl-2-methyloxasilinane-2-carbonitrile?
The canonical SMILES for 6-ethyl-2-methyloxasilinane-2-carbonitrile is CCC1CCC[Si](C)(C#N)O1.
What is the InChIKey of 6-ethyl-2-methyloxasilinane-2-carbonitrile?
The InChIKey is LYPHEUQSPWUSKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NOSi/c1-3-8-5-4-6-11(2,7-9)10-8/h8H,3-6H2,1-2H3.
What are the key properties of 6-ethyl-2-methyloxasilinane-2-carbonitrile?
6-ethyl-2-methyloxasilinane-2-carbonitrile has a molecular weight of 169.30 g/mol, XLogP of 2.21, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-2-methyloxasilinane-2-carbonitrile is sourced from PubChem (CID 18974160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).