tert-butyl-[2-[(2S,5R)-5-methyl-5-propyl-2H-furan-2-yl]ethoxy]-diphenylsilane

C26H36O2Si — CID 11292740

IUPACtert-butyl-[2-[(2S,5R)-5-methyl-5-propyl-2H-furan-2-yl]ethoxy]-diphenylsilane
SMILESCCC[C@]1(C)C=C[C@H](CCO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)O1
InChIInChI=1S/C26H36O2Si/c1-6-19-26(5)20-17-22(28-26)18-21-27-29(25(2,3)4,23-13-9-7-10-14-23)24-15-11-8-12-16-24/h7-17,20,22H,6,18-19,21H2,1-5H3/t22-,26-/m1/s1
InChIKeyFDJVWSFTPNPJGZ-ATIYNZHBSA-N
MW408.66 g/mol
LogP5.47
Rot. Bonds8

About tert-butyl-[2-[(2S,5R)-5-methyl-5-propyl-2H-furan-2-yl]ethoxy]-diphenylsilane

tert-butyl-[2-[(2S,5R)-5-methyl-5-propyl-2H-furan-2-yl]ethoxy]-diphenylsilane (PubChem CID 11292740) has the molecular formula C26H36O2Si and a molecular weight of 408.66 g/mol. Its IUPAC name is tert-butyl-[2-[(2S,5R)-5-methyl-5-propyl-2H-furan-2-yl]ethoxy]-diphenylsilane.

Molecular Properties

Compound Nametert-butyl-[2-[(2S,5R)-5-methyl-5-propyl-2H-furan-2-yl]ethoxy]-diphenylsilane
PubChem CID11292740
Molecular FormulaC26H36O2Si
Molecular Weight408.66 g/mol
Exact Mass408.25
IUPAC Nametert-butyl-[2-[(2S,5R)-5-methyl-5-propyl-2H-furan-2-yl]ethoxy]-diphenylsilane
SMILESCCC[C@]1(C)C=C[C@H](CCO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)O1
InChIInChI=1S/C26H36O2Si/c1-6-19-26(5)20-17-22(28-26)18-21-27-29(25(2,3)4,23-13-9-7-10-14-23)24-15-11-8-12-16-24/h7-17,20,22H,6,18-19,21H2,1-5H3/t22-,26-/m1/s1
InChIKeyFDJVWSFTPNPJGZ-ATIYNZHBSA-N
XLogP5.47
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500408.66
LogP ≤ 55.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze tert-butyl-[2-[(2S,5R)-5-methyl-5-propyl-2H-furan-2-yl]ethoxy]-diphenylsilane 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(cyclopent-2-en-1-yloxy)diphenylsilane
CID 12742150
tert-butyl-[(2S)-1-[(2R)-oxolan-2-yl]propan-2-yl]oxy-diphenylsilane
CID 15249300
3-O-allyl-1,4-anhydro-5-O-t-butyldiphenylsilyl-2-deoxy-d-erythro-pent-1-enitol
CID 129709571
tert-butyl-[(2E,6E)-9-(3,3-dimethyloxiran-2-yl)-3,7-dimethylnona-2,6-dienoxy]-diphenylsilane
CID 11005297
tert-butyl-[[(1S,2S,3S,4R)-3-methyl-7-oxabicyclo[2.2.1]hept-5-en-2-yl]methoxy]-diphenylsilane
CID 11417603
tert-butyl-[(Z)-5-(3,3-dimethyloxiran-2-yl)-3-methylpent-2-enoxy]-diphenylsilane
CID 16059131
Silane, diphenyl(but-2-en-1-yloxy)isohexyloxy-
CID 91732591
Silane, diphenyldi(2-methylpent-3-yloxy)-
CID 91732778
Silane, diphenyldi(2,4-dimethylpent-3-yloxy)-
CID 91732788
Silane, diphenyl(2,4-dimethylpent-3-yloxy)propoxy-
CID 91737884
Silane, diphenylisobutoxy(2-methylpent-3-yloxy)-
CID 91738929
Silane, diphenylbutoxy(3,3-dimethylbut-2-yloxy)-
CID 91738963

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[2-[(2S,5R)-5-methyl-5-propyl-2H-furan-2-yl]ethoxy]-diphenylsilane?
The IUPAC name of tert-butyl-[2-[(2S,5R)-5-methyl-5-propyl-2H-furan-2-yl]ethoxy]-diphenylsilane (CID 11292740) is tert-butyl-[2-[(2S,5R)-5-methyl-5-propyl-2H-furan-2-yl]ethoxy]-diphenylsilane.
What is the SMILES notation for tert-butyl-[2-[(2S,5R)-5-methyl-5-propyl-2H-furan-2-yl]ethoxy]-diphenylsilane?
The canonical SMILES for tert-butyl-[2-[(2S,5R)-5-methyl-5-propyl-2H-furan-2-yl]ethoxy]-diphenylsilane is CCC[C@]1(C)C=C[C@H](CCO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)O1.
What is the InChIKey of tert-butyl-[2-[(2S,5R)-5-methyl-5-propyl-2H-furan-2-yl]ethoxy]-diphenylsilane?
The InChIKey is FDJVWSFTPNPJGZ-ATIYNZHBSA-N. The full InChI is InChI=1S/C26H36O2Si/c1-6-19-26(5)20-17-22(28-26)18-21-27-29(25(2,3)4,23-13-9-7-10-14-23)24-15-11-8-12-16-24/h7-17,20,22H,6,18-19,21H2,1-5H3/t22-,26-/m1/s1.
What are the key properties of tert-butyl-[2-[(2S,5R)-5-methyl-5-propyl-2H-furan-2-yl]ethoxy]-diphenylsilane?
tert-butyl-[2-[(2S,5R)-5-methyl-5-propyl-2H-furan-2-yl]ethoxy]-diphenylsilane has a molecular weight of 408.66 g/mol, XLogP of 5.47, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[2-[(2S,5R)-5-methyl-5-propyl-2H-furan-2-yl]ethoxy]-diphenylsilane is sourced from PubChem (CID 11292740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).