[(1S,2S,5S)-2-methyl-5-(3-trimethylsilylprop-1-en-2-yl)cyclopentyl]methanol

C13H26OSi — CID 134901073

IUPAC[(1S,2S,5S)-2-methyl-5-(3-trimethylsilylprop-1-en-2-yl)cyclopentyl]methanol
SMILESC=C(C[Si](C)(C)C)[C@H]1CC[C@H](C)[C@@H]1CO
InChIInChI=1S/C13H26OSi/c1-10-6-7-12(13(10)8-14)11(2)9-15(3,4)5/h10,12-14H,2,6-9H2,1,3-5H3/t10-,12+,13-/m0/s1
InChIKeyALKWNUXXHQBXTH-UHTWSYAYSA-N
MW226.44 g/mol
LogP3.54
Rot. Bonds4

About [(1S,2S,5S)-2-methyl-5-(3-trimethylsilylprop-1-en-2-yl)cyclopentyl]methanol

[(1S,2S,5S)-2-methyl-5-(3-trimethylsilylprop-1-en-2-yl)cyclopentyl]methanol (PubChem CID 134901073) has the molecular formula C13H26OSi and a molecular weight of 226.44 g/mol. Its IUPAC name is [(1S,2S,5S)-2-methyl-5-(3-trimethylsilylprop-1-en-2-yl)cyclopentyl]methanol.

Molecular Properties

Compound Name[(1S,2S,5S)-2-methyl-5-(3-trimethylsilylprop-1-en-2-yl)cyclopentyl]methanol
PubChem CID134901073
Molecular FormulaC13H26OSi
Molecular Weight226.44 g/mol
Exact Mass226.18
IUPAC Name[(1S,2S,5S)-2-methyl-5-(3-trimethylsilylprop-1-en-2-yl)cyclopentyl]methanol
SMILESC=C(C[Si](C)(C)C)[C@H]1CC[C@H](C)[C@@H]1CO
InChIInChI=1S/C13H26OSi/c1-10-6-7-12(13(10)8-14)11(2)9-15(3,4)5/h10,12-14H,2,6-9H2,1,3-5H3/t10-,12+,13-/m0/s1
InChIKeyALKWNUXXHQBXTH-UHTWSYAYSA-N
XLogP3.54
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.44
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [(1S,2S,5S)-2-methyl-5-(3-trimethylsilylprop-1-en-2-yl)cyclopentyl]methanol?
The IUPAC name of [(1S,2S,5S)-2-methyl-5-(3-trimethylsilylprop-1-en-2-yl)cyclopentyl]methanol (CID 134901073) is [(1S,2S,5S)-2-methyl-5-(3-trimethylsilylprop-1-en-2-yl)cyclopentyl]methanol.
What is the SMILES notation for [(1S,2S,5S)-2-methyl-5-(3-trimethylsilylprop-1-en-2-yl)cyclopentyl]methanol?
The canonical SMILES for [(1S,2S,5S)-2-methyl-5-(3-trimethylsilylprop-1-en-2-yl)cyclopentyl]methanol is C=C(C[Si](C)(C)C)[C@H]1CC[C@H](C)[C@@H]1CO.
What is the InChIKey of [(1S,2S,5S)-2-methyl-5-(3-trimethylsilylprop-1-en-2-yl)cyclopentyl]methanol?
The InChIKey is ALKWNUXXHQBXTH-UHTWSYAYSA-N. The full InChI is InChI=1S/C13H26OSi/c1-10-6-7-12(13(10)8-14)11(2)9-15(3,4)5/h10,12-14H,2,6-9H2,1,3-5H3/t10-,12+,13-/m0/s1.
What are the key properties of [(1S,2S,5S)-2-methyl-5-(3-trimethylsilylprop-1-en-2-yl)cyclopentyl]methanol?
[(1S,2S,5S)-2-methyl-5-(3-trimethylsilylprop-1-en-2-yl)cyclopentyl]methanol has a molecular weight of 226.44 g/mol, XLogP of 3.54, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(1S,2S,5S)-2-methyl-5-(3-trimethylsilylprop-1-en-2-yl)cyclopentyl]methanol is sourced from PubChem (CID 134901073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).