3-(2,2-dimethylazasilolidin-1-yl)cyclopentane-1-carbonitrile

C11H20N2Si — CID 66606409

IUPAC3-(2,2-dimethylazasilolidin-1-yl)cyclopentane-1-carbonitrile
SMILESC[Si]1(C)CCCN1C1CCC(C#N)C1
InChIInChI=1S/C11H20N2Si/c1-14(2)7-3-6-13(14)11-5-4-10(8-11)9-12/h10-11H,3-8H2,1-2H3
InChIKeyUVLSXEJYXXYFLU-UHFFFAOYSA-N
MW208.38 g/mol
LogP2.59
Rot. Bonds1

About 3-(2,2-dimethylazasilolidin-1-yl)cyclopentane-1-carbonitrile

3-(2,2-dimethylazasilolidin-1-yl)cyclopentane-1-carbonitrile (PubChem CID 66606409) has the molecular formula C11H20N2Si and a molecular weight of 208.38 g/mol. Its IUPAC name is 3-(2,2-dimethylazasilolidin-1-yl)cyclopentane-1-carbonitrile.

Molecular Properties

Compound Name3-(2,2-dimethylazasilolidin-1-yl)cyclopentane-1-carbonitrile
PubChem CID66606409
Molecular FormulaC11H20N2Si
Molecular Weight208.38 g/mol
Exact Mass208.14
IUPAC Name3-(2,2-dimethylazasilolidin-1-yl)cyclopentane-1-carbonitrile
SMILESC[Si]1(C)CCCN1C1CCC(C#N)C1
InChIInChI=1S/C11H20N2Si/c1-14(2)7-3-6-13(14)11-5-4-10(8-11)9-12/h10-11H,3-8H2,1-2H3
InChIKeyUVLSXEJYXXYFLU-UHFFFAOYSA-N
XLogP2.59
TPSA27.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.38
LogP ≤ 52.59
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 3-(2,2-dimethylazasilolidin-1-yl)cyclopentane-1-carbonitrile?
The IUPAC name of 3-(2,2-dimethylazasilolidin-1-yl)cyclopentane-1-carbonitrile (CID 66606409) is 3-(2,2-dimethylazasilolidin-1-yl)cyclopentane-1-carbonitrile.
What is the SMILES notation for 3-(2,2-dimethylazasilolidin-1-yl)cyclopentane-1-carbonitrile?
The canonical SMILES for 3-(2,2-dimethylazasilolidin-1-yl)cyclopentane-1-carbonitrile is C[Si]1(C)CCCN1C1CCC(C#N)C1.
What is the InChIKey of 3-(2,2-dimethylazasilolidin-1-yl)cyclopentane-1-carbonitrile?
The InChIKey is UVLSXEJYXXYFLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2Si/c1-14(2)7-3-6-13(14)11-5-4-10(8-11)9-12/h10-11H,3-8H2,1-2H3.
What are the key properties of 3-(2,2-dimethylazasilolidin-1-yl)cyclopentane-1-carbonitrile?
3-(2,2-dimethylazasilolidin-1-yl)cyclopentane-1-carbonitrile has a molecular weight of 208.38 g/mol, XLogP of 2.59, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,2-dimethylazasilolidin-1-yl)cyclopentane-1-carbonitrile is sourced from PubChem (CID 66606409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).