1-cyclobutylethoxy-(cycloheptylmethyl)-ethoxy-methylsilane

C17H34O2Si — CID 141054454

IUPAC1-cyclobutylethoxy-(cycloheptylmethyl)-ethoxy-methylsilane
SMILESCCO[Si](C)(CC1CCCCCC1)OC(C)C1CCC1
InChIInChI=1S/C17H34O2Si/c1-4-18-20(3,19-15(2)17-12-9-13-17)14-16-10-7-5-6-8-11-16/h15-17H,4-14H2,1-3H3
InChIKeyACKPITAAPOVQHO-UHFFFAOYSA-N
MW298.54 g/mol
LogP5.27
Rot. Bonds7

About 1-cyclobutylethoxy-(cycloheptylmethyl)-ethoxy-methylsilane

1-cyclobutylethoxy-(cycloheptylmethyl)-ethoxy-methylsilane (PubChem CID 141054454) has the molecular formula C17H34O2Si and a molecular weight of 298.54 g/mol. Its IUPAC name is 1-cyclobutylethoxy-(cycloheptylmethyl)-ethoxy-methylsilane.

Molecular Properties

Compound Name1-cyclobutylethoxy-(cycloheptylmethyl)-ethoxy-methylsilane
PubChem CID141054454
Molecular FormulaC17H34O2Si
Molecular Weight298.54 g/mol
Exact Mass298.23
IUPAC Name1-cyclobutylethoxy-(cycloheptylmethyl)-ethoxy-methylsilane
SMILESCCO[Si](C)(CC1CCCCCC1)OC(C)C1CCC1
InChIInChI=1S/C17H34O2Si/c1-4-18-20(3,19-15(2)17-12-9-13-17)14-16-10-7-5-6-8-11-16/h15-17H,4-14H2,1-3H3
InChIKeyACKPITAAPOVQHO-UHFFFAOYSA-N
XLogP5.27
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500298.54
LogP ≤ 55.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-cyclohexylethoxy-(cyclopropylmethyl)-ethoxy-methylsilane
CID 141054453
cyclohexyl-(1-cyclohexylethoxy)-ethoxy-ethylsilane
CID 175448536
1-cyclohexylethoxy(trimethyl)silane
CID 20821444
1-cyclopropylethoxy-ethoxy-dimethylsilane
CID 160732775
N-[[diethoxy(methyl)silyl]methyl]cyclohexanamine
CID 18468764
[cyclohexyl(diethoxysilyl)methyl]-(cyclohexylmethyl)-diethoxysilane
CID 123752911
[(1S)-1-ethoxyethyl]cyclohexane
CID 59678198
cyclohexanamine;triethoxy(methyl)silane
CID 67005421
cycloheptylmethyl-(cyclohexylmethoxy)-methoxy-methylsilane
CID 139996965
cyclobutylmethoxy-(cyclopentylmethyl)-methoxy-methylsilane
CID 139996961
(1S)-N-(cyclobutylmethyl)-1-cycloheptylethanamine
CID 81390333
(1R)-N-(cyclobutylmethyl)-1-cyclohexylethanamine
CID 81385089

Frequently Asked Questions

What is the IUPAC name of 1-cyclobutylethoxy-(cycloheptylmethyl)-ethoxy-methylsilane?
The IUPAC name of 1-cyclobutylethoxy-(cycloheptylmethyl)-ethoxy-methylsilane (CID 141054454) is 1-cyclobutylethoxy-(cycloheptylmethyl)-ethoxy-methylsilane.
What is the SMILES notation for 1-cyclobutylethoxy-(cycloheptylmethyl)-ethoxy-methylsilane?
The canonical SMILES for 1-cyclobutylethoxy-(cycloheptylmethyl)-ethoxy-methylsilane is CCO[Si](C)(CC1CCCCCC1)OC(C)C1CCC1.
What is the InChIKey of 1-cyclobutylethoxy-(cycloheptylmethyl)-ethoxy-methylsilane?
The InChIKey is ACKPITAAPOVQHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34O2Si/c1-4-18-20(3,19-15(2)17-12-9-13-17)14-16-10-7-5-6-8-11-16/h15-17H,4-14H2,1-3H3.
What are the key properties of 1-cyclobutylethoxy-(cycloheptylmethyl)-ethoxy-methylsilane?
1-cyclobutylethoxy-(cycloheptylmethyl)-ethoxy-methylsilane has a molecular weight of 298.54 g/mol, XLogP of 5.27, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutylethoxy-(cycloheptylmethyl)-ethoxy-methylsilane is sourced from PubChem (CID 141054454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).