2-quinolin-6-yl-2-trimethylsilyloxyacetonitrile

C14H16N2OSi — CID 63970187

IUPAC2-quinolin-6-yl-2-trimethylsilyloxyacetonitrile
SMILESC[Si](C)(C)OC(C#N)c1ccc2ncccc2c1
InChIInChI=1S/C14H16N2OSi/c1-18(2,3)17-14(10-15)12-6-7-13-11(9-12)5-4-8-16-13/h4-9,14H,1-3H3
InChIKeyBLTZPFBTIOZLTH-UHFFFAOYSA-N
MW256.38 g/mol
LogP3.65
Rot. Bonds3

About 2-quinolin-6-yl-2-trimethylsilyloxyacetonitrile

2-quinolin-6-yl-2-trimethylsilyloxyacetonitrile (PubChem CID 63970187) has the molecular formula C14H16N2OSi and a molecular weight of 256.38 g/mol. Its IUPAC name is 2-quinolin-6-yl-2-trimethylsilyloxyacetonitrile.

Molecular Properties

Compound Name2-quinolin-6-yl-2-trimethylsilyloxyacetonitrile
PubChem CID63970187
Molecular FormulaC14H16N2OSi
Molecular Weight256.38 g/mol
Exact Mass256.10
IUPAC Name2-quinolin-6-yl-2-trimethylsilyloxyacetonitrile
SMILESC[Si](C)(C)OC(C#N)c1ccc2ncccc2c1
InChIInChI=1S/C14H16N2OSi/c1-18(2,3)17-14(10-15)12-6-7-13-11(9-12)5-4-8-16-13/h4-9,14H,1-3H3
InChIKeyBLTZPFBTIOZLTH-UHFFFAOYSA-N
XLogP3.65
TPSA45.91 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.38
LogP ≤ 53.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-amino-2-quinolin-6-ylacetonitrile
CID 63968103
2-(propan-2-ylamino)-2-quinolin-6-ylacetonitrile
CID 63968719
6-(3-quinolin-6-ylbutan-2-yl)quinoline
CID 20658775
2-(diethylamino)-2-quinolin-6-ylacetonitrile
CID 63970802
3-amino-3-quinolin-6-ylpropanenitrile
CID 55273076
2-(4-methylpiperazin-1-yl)-2-quinolin-6-ylacetonitrile
CID 65420095
2-(cyclopropylmethylamino)-2-quinolin-6-ylacetonitrile
CID 63969155
6-propan-2-ylquinoline;sulfur dioxide
CID 162251791
2-[hydroxy(quinolin-6-yl)methyl]-2-methylbutanenitrile
CID 79133168
2-(4-fluoroanilino)-2-quinolin-6-ylacetonitrile
CID 63969132
2-quinolin-6-ylpropan-1-amine
CID 79002101
6-(1-nitrosoethyl)quinoline
CID 54028651

Frequently Asked Questions

What is the IUPAC name of 2-quinolin-6-yl-2-trimethylsilyloxyacetonitrile?
The IUPAC name of 2-quinolin-6-yl-2-trimethylsilyloxyacetonitrile (CID 63970187) is 2-quinolin-6-yl-2-trimethylsilyloxyacetonitrile.
What is the SMILES notation for 2-quinolin-6-yl-2-trimethylsilyloxyacetonitrile?
The canonical SMILES for 2-quinolin-6-yl-2-trimethylsilyloxyacetonitrile is C[Si](C)(C)OC(C#N)c1ccc2ncccc2c1.
What is the InChIKey of 2-quinolin-6-yl-2-trimethylsilyloxyacetonitrile?
The InChIKey is BLTZPFBTIOZLTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2OSi/c1-18(2,3)17-14(10-15)12-6-7-13-11(9-12)5-4-8-16-13/h4-9,14H,1-3H3.
What are the key properties of 2-quinolin-6-yl-2-trimethylsilyloxyacetonitrile?
2-quinolin-6-yl-2-trimethylsilyloxyacetonitrile has a molecular weight of 256.38 g/mol, XLogP of 3.65, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-quinolin-6-yl-2-trimethylsilyloxyacetonitrile is sourced from PubChem (CID 63970187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).