N-benzyl-2-[(E)-2-trimethylsilylethenyl]cyclopentan-1-amine

C17H27NSi — CID 20765174

IUPACN-benzyl-2-[(E)-2-trimethylsilylethenyl]cyclopentan-1-amine
SMILESC[Si](C)(C)/C=C/C1CCCC1NCc1ccccc1
InChIInChI=1S/C17H27NSi/c1-19(2,3)13-12-16-10-7-11-17(16)18-14-15-8-5-4-6-9-15/h4-6,8-9,12-13,16-18H,7,10-11,14H2,1-3H3/b13-12+
InChIKeyIUFRYADRVJEMBC-OUKQBFOZSA-N
MW273.50 g/mol
LogP4.38
Rot. Bonds5

About N-benzyl-2-[(E)-2-trimethylsilylethenyl]cyclopentan-1-amine

N-benzyl-2-[(E)-2-trimethylsilylethenyl]cyclopentan-1-amine (PubChem CID 20765174) has the molecular formula C17H27NSi and a molecular weight of 273.50 g/mol. Its IUPAC name is N-benzyl-2-[(E)-2-trimethylsilylethenyl]cyclopentan-1-amine.

Molecular Properties

Compound NameN-benzyl-2-[(E)-2-trimethylsilylethenyl]cyclopentan-1-amine
PubChem CID20765174
Molecular FormulaC17H27NSi
Molecular Weight273.50 g/mol
Exact Mass273.19
IUPAC NameN-benzyl-2-[(E)-2-trimethylsilylethenyl]cyclopentan-1-amine
SMILESC[Si](C)(C)/C=C/C1CCCC1NCc1ccccc1
InChIInChI=1S/C17H27NSi/c1-19(2,3)13-12-16-10-7-11-17(16)18-14-15-8-5-4-6-9-15/h4-6,8-9,12-13,16-18H,7,10-11,14H2,1-3H3/b13-12+
InChIKeyIUFRYADRVJEMBC-OUKQBFOZSA-N
XLogP4.38
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.50
LogP ≤ 54.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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 N-benzyl-2-[(E)-2-trimethylsilylethenyl]cyclopentan-1-amine?
The IUPAC name of N-benzyl-2-[(E)-2-trimethylsilylethenyl]cyclopentan-1-amine (CID 20765174) is N-benzyl-2-[(E)-2-trimethylsilylethenyl]cyclopentan-1-amine.
What is the SMILES notation for N-benzyl-2-[(E)-2-trimethylsilylethenyl]cyclopentan-1-amine?
The canonical SMILES for N-benzyl-2-[(E)-2-trimethylsilylethenyl]cyclopentan-1-amine is C[Si](C)(C)/C=C/C1CCCC1NCc1ccccc1.
What is the InChIKey of N-benzyl-2-[(E)-2-trimethylsilylethenyl]cyclopentan-1-amine?
The InChIKey is IUFRYADRVJEMBC-OUKQBFOZSA-N. The full InChI is InChI=1S/C17H27NSi/c1-19(2,3)13-12-16-10-7-11-17(16)18-14-15-8-5-4-6-9-15/h4-6,8-9,12-13,16-18H,7,10-11,14H2,1-3H3/b13-12+.
What are the key properties of N-benzyl-2-[(E)-2-trimethylsilylethenyl]cyclopentan-1-amine?
N-benzyl-2-[(E)-2-trimethylsilylethenyl]cyclopentan-1-amine has a molecular weight of 273.50 g/mol, XLogP of 4.38, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-[(E)-2-trimethylsilylethenyl]cyclopentan-1-amine is sourced from PubChem (CID 20765174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).