[2-[[tert-butyl(diphenyl)silyl]oxymethyl]cyclopentyl]methanamine

C23H33NOSi — CID 123316179

IUPAC[2-[[tert-butyl(diphenyl)silyl]oxymethyl]cyclopentyl]methanamine
SMILESCC(C)(C)[Si](OCC1CCCC1CN)(c1ccccc1)c1ccccc1
InChIInChI=1S/C23H33NOSi/c1-23(2,3)26(21-13-6-4-7-14-21,22-15-8-5-9-16-22)25-18-20-12-10-11-19(20)17-24/h4-9,13-16,19-20H,10-12,17-18,24H2,1-3H3
InChIKeyLMKJQOXWLYRTES-UHFFFAOYSA-N
MW367.61 g/mol
LogP3.94
Rot. Bonds6

About [2-[[tert-butyl(diphenyl)silyl]oxymethyl]cyclopentyl]methanamine

[2-[[tert-butyl(diphenyl)silyl]oxymethyl]cyclopentyl]methanamine (PubChem CID 123316179) has the molecular formula C23H33NOSi and a molecular weight of 367.61 g/mol. Its IUPAC name is [2-[[tert-butyl(diphenyl)silyl]oxymethyl]cyclopentyl]methanamine.

Molecular Properties

Compound Name[2-[[tert-butyl(diphenyl)silyl]oxymethyl]cyclopentyl]methanamine
PubChem CID123316179
Molecular FormulaC23H33NOSi
Molecular Weight367.61 g/mol
Exact Mass367.23
IUPAC Name[2-[[tert-butyl(diphenyl)silyl]oxymethyl]cyclopentyl]methanamine
SMILESCC(C)(C)[Si](OCC1CCCC1CN)(c1ccccc1)c1ccccc1
InChIInChI=1S/C23H33NOSi/c1-23(2,3)26(21-13-6-4-7-14-21,22-15-8-5-9-16-22)25-18-20-12-10-11-19(20)17-24/h4-9,13-16,19-20H,10-12,17-18,24H2,1-3H3
InChIKeyLMKJQOXWLYRTES-UHFFFAOYSA-N
XLogP3.94
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.61
LogP ≤ 53.94
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 [2-[[tert-butyl(diphenyl)silyl]oxymethyl]cyclopentyl]methanamine?
The IUPAC name of [2-[[tert-butyl(diphenyl)silyl]oxymethyl]cyclopentyl]methanamine (CID 123316179) is [2-[[tert-butyl(diphenyl)silyl]oxymethyl]cyclopentyl]methanamine.
What is the SMILES notation for [2-[[tert-butyl(diphenyl)silyl]oxymethyl]cyclopentyl]methanamine?
The canonical SMILES for [2-[[tert-butyl(diphenyl)silyl]oxymethyl]cyclopentyl]methanamine is CC(C)(C)[Si](OCC1CCCC1CN)(c1ccccc1)c1ccccc1.
What is the InChIKey of [2-[[tert-butyl(diphenyl)silyl]oxymethyl]cyclopentyl]methanamine?
The InChIKey is LMKJQOXWLYRTES-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H33NOSi/c1-23(2,3)26(21-13-6-4-7-14-21,22-15-8-5-9-16-22)25-18-20-12-10-11-19(20)17-24/h4-9,13-16,19-20H,10-12,17-18,24H2,1-3H3.
What are the key properties of [2-[[tert-butyl(diphenyl)silyl]oxymethyl]cyclopentyl]methanamine?
[2-[[tert-butyl(diphenyl)silyl]oxymethyl]cyclopentyl]methanamine has a molecular weight of 367.61 g/mol, XLogP of 3.94, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[[tert-butyl(diphenyl)silyl]oxymethyl]cyclopentyl]methanamine is sourced from PubChem (CID 123316179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).