[(1R)-1-(1-butylcyclobutyl)prop-2-ynoxy]-trimethylsilane

C14H26OSi — CID 129404611

IUPAC[(1R)-1-(1-butylcyclobutyl)prop-2-ynoxy]-trimethylsilane
SMILESC#C[C@H](O[Si](C)(C)C)C1(CCCC)CCC1
InChIInChI=1S/C14H26OSi/c1-6-8-10-14(11-9-12-14)13(7-2)15-16(3,4)5/h2,13H,6,8-12H2,1,3-5H3/t13-/m0/s1
InChIKeyHHFRHAWIFDKCDE-ZDUSSCGKSA-N
MW238.45 g/mol
LogP4.20
Rot. Bonds6

About [(1R)-1-(1-butylcyclobutyl)prop-2-ynoxy]-trimethylsilane

[(1R)-1-(1-butylcyclobutyl)prop-2-ynoxy]-trimethylsilane (PubChem CID 129404611) has the molecular formula C14H26OSi and a molecular weight of 238.45 g/mol. Its IUPAC name is [(1R)-1-(1-butylcyclobutyl)prop-2-ynoxy]-trimethylsilane.

Molecular Properties

Compound Name[(1R)-1-(1-butylcyclobutyl)prop-2-ynoxy]-trimethylsilane
PubChem CID129404611
Molecular FormulaC14H26OSi
Molecular Weight238.45 g/mol
Exact Mass238.18
IUPAC Name[(1R)-1-(1-butylcyclobutyl)prop-2-ynoxy]-trimethylsilane
SMILESC#C[C@H](O[Si](C)(C)C)C1(CCCC)CCC1
InChIInChI=1S/C14H26OSi/c1-6-8-10-14(11-9-12-14)13(7-2)15-16(3,4)5/h2,13H,6,8-12H2,1,3-5H3/t13-/m0/s1
InChIKeyHHFRHAWIFDKCDE-ZDUSSCGKSA-N
XLogP4.20
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.45
LogP ≤ 54.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

{[1-(1-Butylcyclobutyl)prop-2-yn-1-yl]oxy}(trimethyl)silane
CID 12786176
tert-Butyldimethyl-[1-(1-propylcyclobutyl)but-3-ynyloxy]silane
CID 15475299
Tert-butyl-(4,4-dimethyloct-1-yn-3-yloxy)-dimethylsilane
CID 19042215
5,5-Dimethylnon-1-yn-4-yloxy(trimethyl)silane
CID 20288770
5,5-Dimethyloct-1-yn-4-yloxy(trimethyl)silane
CID 20288807
1-(1-But-2-ynylcyclobutyl)prop-2-ynoxy-trimethylsilane
CID 20383883
3-Trimethylsilyloxy-4,4-dimethyl-1-octyne
CID 20442069
{[1-(1-Butylcyclobutyl)-3-iodoprop-2-yn-1-yl]oxy}(trimethyl)silane
CID 20565020
1-(1-Hexylcyclobutyl)prop-2-ynoxy-trimethylsilane
CID 20565032
1-(1-Butylcyclopentyl)prop-2-ynoxy-trimethylsilane
CID 20565042
Trimethyl-[1-(1-pentylcyclobutyl)prop-2-ynoxy]silane
CID 20565048
Trimethyl-[1-(1-propylcyclobutyl)prop-2-ynoxy]silane
CID 20565090

Frequently Asked Questions

What is the IUPAC name of [(1R)-1-(1-butylcyclobutyl)prop-2-ynoxy]-trimethylsilane?
The IUPAC name of [(1R)-1-(1-butylcyclobutyl)prop-2-ynoxy]-trimethylsilane (CID 129404611) is [(1R)-1-(1-butylcyclobutyl)prop-2-ynoxy]-trimethylsilane.
What is the SMILES notation for [(1R)-1-(1-butylcyclobutyl)prop-2-ynoxy]-trimethylsilane?
The canonical SMILES for [(1R)-1-(1-butylcyclobutyl)prop-2-ynoxy]-trimethylsilane is C#C[C@H](O[Si](C)(C)C)C1(CCCC)CCC1.
What is the InChIKey of [(1R)-1-(1-butylcyclobutyl)prop-2-ynoxy]-trimethylsilane?
The InChIKey is HHFRHAWIFDKCDE-ZDUSSCGKSA-N. The full InChI is InChI=1S/C14H26OSi/c1-6-8-10-14(11-9-12-14)13(7-2)15-16(3,4)5/h2,13H,6,8-12H2,1,3-5H3/t13-/m0/s1.
What are the key properties of [(1R)-1-(1-butylcyclobutyl)prop-2-ynoxy]-trimethylsilane?
[(1R)-1-(1-butylcyclobutyl)prop-2-ynoxy]-trimethylsilane has a molecular weight of 238.45 g/mol, XLogP of 4.20, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R)-1-(1-butylcyclobutyl)prop-2-ynoxy]-trimethylsilane is sourced from PubChem (CID 129404611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).