tert-butyl-[4-[3-(2-methoxypropan-2-yloxy)cyclopenten-1-yl]butoxy]-dimethylsilane

C19H38O3Si — CID 10315372

IUPACtert-butyl-[4-[3-(2-methoxypropan-2-yloxy)cyclopenten-1-yl]butoxy]-dimethylsilane
SMILESCOC(C)(C)OC1C=C(CCCCO[Si](C)(C)C(C)(C)C)CC1
InChIInChI=1S/C19H38O3Si/c1-18(2,3)23(7,8)21-14-10-9-11-16-12-13-17(15-16)22-19(4,5)20-6/h15,17H,9-14H2,1-8H3
InChIKeyKHMPZHLRDUTNES-UHFFFAOYSA-N
MW342.60 g/mol
LogP5.67
Rot. Bonds9

About tert-butyl-[4-[3-(2-methoxypropan-2-yloxy)cyclopenten-1-yl]butoxy]-dimethylsilane

tert-butyl-[4-[3-(2-methoxypropan-2-yloxy)cyclopenten-1-yl]butoxy]-dimethylsilane (PubChem CID 10315372) has the molecular formula C19H38O3Si and a molecular weight of 342.60 g/mol. Its IUPAC name is tert-butyl-[4-[3-(2-methoxypropan-2-yloxy)cyclopenten-1-yl]butoxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[4-[3-(2-methoxypropan-2-yloxy)cyclopenten-1-yl]butoxy]-dimethylsilane
PubChem CID10315372
Molecular FormulaC19H38O3Si
Molecular Weight342.60 g/mol
Exact Mass342.26
IUPAC Nametert-butyl-[4-[3-(2-methoxypropan-2-yloxy)cyclopenten-1-yl]butoxy]-dimethylsilane
SMILESCOC(C)(C)OC1C=C(CCCCO[Si](C)(C)C(C)(C)C)CC1
InChIInChI=1S/C19H38O3Si/c1-18(2,3)23(7,8)21-14-10-9-11-16-12-13-17(15-16)22-19(4,5)20-6/h15,17H,9-14H2,1-8H3
InChIKeyKHMPZHLRDUTNES-UHFFFAOYSA-N
XLogP5.67
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500342.60
LogP ≤ 55.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze tert-butyl-[4-[3-(2-methoxypropan-2-yloxy)cyclopenten-1-yl]butoxy]-dimethylsilane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

tert-butyl-[6-[tert-butyl(dimethyl)silyl]oxyhexoxy]-dimethylsilane
CID 6430202
tert-butyl-[5-[tert-butyl(dimethyl)silyl]oxypentoxy]-dimethylsilane
CID 529127
tert-butyl-[10-[tert-butyl(dimethyl)silyl]oxydecoxy]-dimethylsilane
CID 6430197
2-[7-[tert-butyl(dimethyl)silyl]oxyheptyl]-4-hydroxycyclopent-2-en-1-one
CID 139675795
tert-butyl-hexacosoxy-dimethylsilane
CID 6430213
[(3S)-3-[tert-butyl(dimethyl)silyl]oxycyclopenten-1-yl]methanol
CID 46193781
tert-butyl-[4-[(4E)-4-ethylidene-2,3-dihydropyrrol-5-yl]butoxy]-dimethylsilane
CID 44543139
azane;butoxy-tert-butyl-dimethylsilane
CID 87971025
tert-butyl-dimethyl-(8-thiophen-2-yloctoxy)silane
CID 140913096
2,6-bis[4-[tert-butyl(dimethyl)silyl]oxybutyl]cyclohexan-1-one
CID 10928807
(3aR,6aS)-5-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-3,3a,4,6a-tetrahydro-1H-pentalen-2-one
CID 67769546
trans-(2R,5S)-2-[4-[tert-butyl(dimethyl)silyl]oxybutyl]-5-methylcyclohexan-1-one
CID 10870267

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[4-[3-(2-methoxypropan-2-yloxy)cyclopenten-1-yl]butoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[4-[3-(2-methoxypropan-2-yloxy)cyclopenten-1-yl]butoxy]-dimethylsilane (CID 10315372) is tert-butyl-[4-[3-(2-methoxypropan-2-yloxy)cyclopenten-1-yl]butoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[4-[3-(2-methoxypropan-2-yloxy)cyclopenten-1-yl]butoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[4-[3-(2-methoxypropan-2-yloxy)cyclopenten-1-yl]butoxy]-dimethylsilane is COC(C)(C)OC1C=C(CCCCO[Si](C)(C)C(C)(C)C)CC1.
What is the InChIKey of tert-butyl-[4-[3-(2-methoxypropan-2-yloxy)cyclopenten-1-yl]butoxy]-dimethylsilane?
The InChIKey is KHMPZHLRDUTNES-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H38O3Si/c1-18(2,3)23(7,8)21-14-10-9-11-16-12-13-17(15-16)22-19(4,5)20-6/h15,17H,9-14H2,1-8H3.
What are the key properties of tert-butyl-[4-[3-(2-methoxypropan-2-yloxy)cyclopenten-1-yl]butoxy]-dimethylsilane?
tert-butyl-[4-[3-(2-methoxypropan-2-yloxy)cyclopenten-1-yl]butoxy]-dimethylsilane has a molecular weight of 342.60 g/mol, XLogP of 5.67, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[4-[3-(2-methoxypropan-2-yloxy)cyclopenten-1-yl]butoxy]-dimethylsilane is sourced from PubChem (CID 10315372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).