bicyclo[2.2.1]heptane-2-carbonitrile;tetramethylsilane

C12H23NSi — CID 90949239

IUPACbicyclo[2.2.1]heptane-2-carbonitrile;tetramethylsilane
SMILESC[Si](C)(C)C.N#CC1CC2CCC1C2
InChIInChI=1S/C8H11N.C4H12Si/c9-5-8-4-6-1-2-7(8)3-6;1-5(2,3)4/h6-8H,1-4H2;1-4H3
InChIKeyYRVHPZOYRNRVSI-UHFFFAOYSA-N
MW209.41 g/mol
LogP3.90
Rot. Bonds

About bicyclo[2.2.1]heptane-2-carbonitrile;tetramethylsilane

bicyclo[2.2.1]heptane-2-carbonitrile;tetramethylsilane (PubChem CID 90949239) has the molecular formula C12H23NSi and a molecular weight of 209.41 g/mol. Its IUPAC name is bicyclo[2.2.1]heptane-2-carbonitrile;tetramethylsilane.

Molecular Properties

Compound Namebicyclo[2.2.1]heptane-2-carbonitrile;tetramethylsilane
PubChem CID90949239
Molecular FormulaC12H23NSi
Molecular Weight209.41 g/mol
Exact Mass209.16
IUPAC Namebicyclo[2.2.1]heptane-2-carbonitrile;tetramethylsilane
SMILESC[Si](C)(C)C.N#CC1CC2CCC1C2
InChIInChI=1S/C8H11N.C4H12Si/c9-5-8-4-6-1-2-7(8)3-6;1-5(2,3)4/h6-8H,1-4H2;1-4H3
InChIKeyYRVHPZOYRNRVSI-UHFFFAOYSA-N
XLogP3.90
TPSA23.79 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.41
LogP ≤ 53.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(1R,2R,4R)-bicyclo[2.2.1]heptane-2-carbonitrile
CID 6994024
[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]-trimethylsilane
CID 125472918
(1R,4R,5R,6R)-4-hydroxybicyclo[3.2.1]octane-6-carbonitrile
CID 11859739
2-bicyclo[2.2.1]heptanyl-ethynyl-dimethylsilane
CID 15050662
bicyclo[2.2.1]heptan-2-ol;methoxy(trimethyl)silane
CID 158307954
[(1R,2R,4S)-2-bicyclo[2.2.1]heptanyl]cyanamide
CID 55287804
bicyclo[2.2.1]heptan-2-ol;ethane
CID 143739215
[(1S,2R,4R)-2-bicyclo[2.2.1]heptanyl]-ditert-butylphosphane
CID 124674169
2-[(1S,2R,4R)-2-bicyclo[2.2.1]heptanyl]propanedinitrile
CID 11252164
2-bromobicyclo[2.2.1]heptane;methanamine
CID 174462480
(1R,2R,4S)-2-methylbicyclo[2.2.1]heptane
CID 98050554
2-bicyclo[2.2.1]heptanyl-dimethoxy-methylsilane
CID 54452110

Frequently Asked Questions

What is the IUPAC name of bicyclo[2.2.1]heptane-2-carbonitrile;tetramethylsilane?
The IUPAC name of bicyclo[2.2.1]heptane-2-carbonitrile;tetramethylsilane (CID 90949239) is bicyclo[2.2.1]heptane-2-carbonitrile;tetramethylsilane.
What is the SMILES notation for bicyclo[2.2.1]heptane-2-carbonitrile;tetramethylsilane?
The canonical SMILES for bicyclo[2.2.1]heptane-2-carbonitrile;tetramethylsilane is C[Si](C)(C)C.N#CC1CC2CCC1C2.
What is the InChIKey of bicyclo[2.2.1]heptane-2-carbonitrile;tetramethylsilane?
The InChIKey is YRVHPZOYRNRVSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N.C4H12Si/c9-5-8-4-6-1-2-7(8)3-6;1-5(2,3)4/h6-8H,1-4H2;1-4H3.
What are the key properties of bicyclo[2.2.1]heptane-2-carbonitrile;tetramethylsilane?
bicyclo[2.2.1]heptane-2-carbonitrile;tetramethylsilane has a molecular weight of 209.41 g/mol, XLogP of 3.90, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for bicyclo[2.2.1]heptane-2-carbonitrile;tetramethylsilane is sourced from PubChem (CID 90949239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).