3-(1-trimethylsilylethylamino)cyclopentane-1-carbonitrile

C11H22N2Si — CID 67326170

IUPAC3-(1-trimethylsilylethylamino)cyclopentane-1-carbonitrile
SMILESCC(NC1CCC(C#N)C1)[Si](C)(C)C
InChIInChI=1S/C11H22N2Si/c1-9(14(2,3)4)13-11-6-5-10(7-11)8-12/h9-11,13H,5-7H2,1-4H3
InChIKeyKPRLUEVWSCKLHJ-UHFFFAOYSA-N
MW210.40 g/mol
LogP2.53
Rot. Bonds3

About 3-(1-trimethylsilylethylamino)cyclopentane-1-carbonitrile

3-(1-trimethylsilylethylamino)cyclopentane-1-carbonitrile (PubChem CID 67326170) has the molecular formula C11H22N2Si and a molecular weight of 210.40 g/mol. Its IUPAC name is 3-(1-trimethylsilylethylamino)cyclopentane-1-carbonitrile.

Molecular Properties

Compound Name3-(1-trimethylsilylethylamino)cyclopentane-1-carbonitrile
PubChem CID67326170
Molecular FormulaC11H22N2Si
Molecular Weight210.40 g/mol
Exact Mass210.16
IUPAC Name3-(1-trimethylsilylethylamino)cyclopentane-1-carbonitrile
SMILESCC(NC1CCC(C#N)C1)[Si](C)(C)C
InChIInChI=1S/C11H22N2Si/c1-9(14(2,3)4)13-11-6-5-10(7-11)8-12/h9-11,13H,5-7H2,1-4H3
InChIKeyKPRLUEVWSCKLHJ-UHFFFAOYSA-N
XLogP2.53
TPSA35.82 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.40
LogP ≤ 52.53
H-Bond Donors ≤ 51
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-(1-trimethylsilylethylamino)cyclopentane-1-carbonitrile?
The IUPAC name of 3-(1-trimethylsilylethylamino)cyclopentane-1-carbonitrile (CID 67326170) is 3-(1-trimethylsilylethylamino)cyclopentane-1-carbonitrile.
What is the SMILES notation for 3-(1-trimethylsilylethylamino)cyclopentane-1-carbonitrile?
The canonical SMILES for 3-(1-trimethylsilylethylamino)cyclopentane-1-carbonitrile is CC(NC1CCC(C#N)C1)[Si](C)(C)C.
What is the InChIKey of 3-(1-trimethylsilylethylamino)cyclopentane-1-carbonitrile?
The InChIKey is KPRLUEVWSCKLHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2Si/c1-9(14(2,3)4)13-11-6-5-10(7-11)8-12/h9-11,13H,5-7H2,1-4H3.
What are the key properties of 3-(1-trimethylsilylethylamino)cyclopentane-1-carbonitrile?
3-(1-trimethylsilylethylamino)cyclopentane-1-carbonitrile has a molecular weight of 210.40 g/mol, XLogP of 2.53, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-trimethylsilylethylamino)cyclopentane-1-carbonitrile is sourced from PubChem (CID 67326170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).