[(3R,5S)-3-[tert-butyl(dimethyl)silyl]oxy-5-(2-ethoxyethoxy)cyclopenten-1-yl]methanol

C16H32O4Si — CID 10980038

IUPAC[(3R,5S)-3-[tert-butyl(dimethyl)silyl]oxy-5-(2-ethoxyethoxy)cyclopenten-1-yl]methanol
SMILESCCOCCO[C@H]1C[C@@H](O[Si](C)(C)C(C)(C)C)C=C1CO
InChIInChI=1S/C16H32O4Si/c1-7-18-8-9-19-15-11-14(10-13(15)12-17)20-21(5,6)16(2,3)4/h10,14-15,17H,7-9,11-12H2,1-6H3/t14-,15-/m0/s1
InChIKeyIQODEFLVJGBGMW-GJZGRUSLSA-N
MW316.51 g/mol
LogP3.12
Rot. Bonds8

About [(3R,5S)-3-[tert-butyl(dimethyl)silyl]oxy-5-(2-ethoxyethoxy)cyclopenten-1-yl]methanol

[(3R,5S)-3-[tert-butyl(dimethyl)silyl]oxy-5-(2-ethoxyethoxy)cyclopenten-1-yl]methanol (PubChem CID 10980038) has the molecular formula C16H32O4Si and a molecular weight of 316.51 g/mol. Its IUPAC name is [(3R,5S)-3-[tert-butyl(dimethyl)silyl]oxy-5-(2-ethoxyethoxy)cyclopenten-1-yl]methanol.

Molecular Properties

Compound Name[(3R,5S)-3-[tert-butyl(dimethyl)silyl]oxy-5-(2-ethoxyethoxy)cyclopenten-1-yl]methanol
PubChem CID10980038
Molecular FormulaC16H32O4Si
Molecular Weight316.51 g/mol
Exact Mass316.21
IUPAC Name[(3R,5S)-3-[tert-butyl(dimethyl)silyl]oxy-5-(2-ethoxyethoxy)cyclopenten-1-yl]methanol
SMILESCCOCCO[C@H]1C[C@@H](O[Si](C)(C)C(C)(C)C)C=C1CO
InChIInChI=1S/C16H32O4Si/c1-7-18-8-9-19-15-11-14(10-13(15)12-17)20-21(5,6)16(2,3)4/h10,14-15,17H,7-9,11-12H2,1-6H3/t14-,15-/m0/s1
InChIKeyIQODEFLVJGBGMW-GJZGRUSLSA-N
XLogP3.12
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.51
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze [(3R,5S)-3-[tert-butyl(dimethyl)silyl]oxy-5-(2-ethoxyethoxy)cyclopenten-1-yl]methanol 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

(8S,9aR)-2,2,4,4-tetra(propan-2-yl)-6,8,9,9a-tetrahydrocyclopenta[f][1,3,5,2,4]trioxadisilocin-8-ol
CID 57930814
(E)-7-[tert-butyl(dimethyl)silyl]oxy-1-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]hept-1-en-3-ol
CID 10665166
(2R,3S,6R)-6-[(1R)-2-[tert-butyl(dimethyl)silyl]oxy-1-hydroxyethyl]-5-methyl-2-[tri(propan-2-yl)silyloxymethyl]-3,6-dihydro-2H-pyran-3-ol
CID 10672201
(E,6R)-6-[(2R,5R)-5-[(1R)-1-[tert-butyl(dimethyl)silyl]oxyundecyl]oxolan-2-yl]hex-2-ene-1,6-diol
CID 10983566
(1R,4S,5S)-4,5-bis[[tert-butyl(dimethyl)silyl]oxy]-2-(hydroxymethyl)cyclopent-2-en-1-ol
CID 11057858
(1R,4S)-4-[(E)-4-[(2-methylpropan-2-yl)oxy]-1-tri(propan-2-yl)silyloxybut-2-en-2-yl]cyclopent-2-en-1-ol
CID 11058067
(E,6S)-6-[(2S,5R)-5-[(1R)-1-[tert-butyl(dimethyl)silyl]oxytridec-12-enyl]oxolan-2-yl]hex-2-ene-1,6-diol
CID 11477497
(E)-3-[(2R,3aS,5R,6R,8Z,10aS)-5-ethyl-6-triethylsilyloxy-2,3,3a,5,6,7,10,10a-octahydrofuro[3,2-b]oxonin-2-yl]prop-2-en-1-ol
CID 11773492
(1R,4S,5S)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-4,5-bis(methoxymethoxy)cyclopent-2-en-1-ol
CID 11783020
(1S,4S,5S)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-4,5-bis(methoxymethoxy)cyclopent-2-en-1-ol
CID 11783021
(E)-3-[(4S,5S)-5-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-2,2-dimethyl-1,3-dioxolan-4-yl]but-2-en-1-ol
CID 16756355
(E,4S,5S)-5-[tert-butyl(dimethyl)silyl]oxy-4-methoxy-2-methyloct-2-en-1-ol
CID 45141916

Frequently Asked Questions

What is the IUPAC name of [(3R,5S)-3-[tert-butyl(dimethyl)silyl]oxy-5-(2-ethoxyethoxy)cyclopenten-1-yl]methanol?
The IUPAC name of [(3R,5S)-3-[tert-butyl(dimethyl)silyl]oxy-5-(2-ethoxyethoxy)cyclopenten-1-yl]methanol (CID 10980038) is [(3R,5S)-3-[tert-butyl(dimethyl)silyl]oxy-5-(2-ethoxyethoxy)cyclopenten-1-yl]methanol.
What is the SMILES notation for [(3R,5S)-3-[tert-butyl(dimethyl)silyl]oxy-5-(2-ethoxyethoxy)cyclopenten-1-yl]methanol?
The canonical SMILES for [(3R,5S)-3-[tert-butyl(dimethyl)silyl]oxy-5-(2-ethoxyethoxy)cyclopenten-1-yl]methanol is CCOCCO[C@H]1C[C@@H](O[Si](C)(C)C(C)(C)C)C=C1CO.
What is the InChIKey of [(3R,5S)-3-[tert-butyl(dimethyl)silyl]oxy-5-(2-ethoxyethoxy)cyclopenten-1-yl]methanol?
The InChIKey is IQODEFLVJGBGMW-GJZGRUSLSA-N. The full InChI is InChI=1S/C16H32O4Si/c1-7-18-8-9-19-15-11-14(10-13(15)12-17)20-21(5,6)16(2,3)4/h10,14-15,17H,7-9,11-12H2,1-6H3/t14-,15-/m0/s1.
What are the key properties of [(3R,5S)-3-[tert-butyl(dimethyl)silyl]oxy-5-(2-ethoxyethoxy)cyclopenten-1-yl]methanol?
[(3R,5S)-3-[tert-butyl(dimethyl)silyl]oxy-5-(2-ethoxyethoxy)cyclopenten-1-yl]methanol has a molecular weight of 316.51 g/mol, XLogP of 3.12, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(3R,5S)-3-[tert-butyl(dimethyl)silyl]oxy-5-(2-ethoxyethoxy)cyclopenten-1-yl]methanol is sourced from PubChem (CID 10980038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).