(E,1S,2R)-2-methyl-1-phenyl-5-trimethylsilylpent-3-en-1-ol

C15H24OSi — CID 102275587

IUPAC(E,1S,2R)-2-methyl-1-phenyl-5-trimethylsilylpent-3-en-1-ol
SMILESC[C@H](/C=C/C[Si](C)(C)C)[C@H](O)c1ccccc1
InChIInChI=1S/C15H24OSi/c1-13(9-8-12-17(2,3)4)15(16)14-10-6-5-7-11-14/h5-11,13,15-16H,12H2,1-4H3/b9-8+/t13-,15+/m1/s1
InChIKeyFZYRLBXBDBQGBE-HOMMJUPQSA-N
MW248.44 g/mol
LogP4.25
Rot. Bonds5

About (E,1S,2R)-2-methyl-1-phenyl-5-trimethylsilylpent-3-en-1-ol

(E,1S,2R)-2-methyl-1-phenyl-5-trimethylsilylpent-3-en-1-ol (PubChem CID 102275587) has the molecular formula C15H24OSi and a molecular weight of 248.44 g/mol. Its IUPAC name is (E,1S,2R)-2-methyl-1-phenyl-5-trimethylsilylpent-3-en-1-ol.

Molecular Properties

Compound Name(E,1S,2R)-2-methyl-1-phenyl-5-trimethylsilylpent-3-en-1-ol
PubChem CID102275587
Molecular FormulaC15H24OSi
Molecular Weight248.44 g/mol
Exact Mass248.16
IUPAC Name(E,1S,2R)-2-methyl-1-phenyl-5-trimethylsilylpent-3-en-1-ol
SMILESC[C@H](/C=C/C[Si](C)(C)C)[C@H](O)c1ccccc1
InChIInChI=1S/C15H24OSi/c1-13(9-8-12-17(2,3)4)15(16)14-10-6-5-7-11-14/h5-11,13,15-16H,12H2,1-4H3/b9-8+/t13-,15+/m1/s1
InChIKeyFZYRLBXBDBQGBE-HOMMJUPQSA-N
XLogP4.25
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.44
LogP ≤ 54.25
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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Related Compounds

trimethyl-[(E)-4-phenylpent-2-enyl]silane
CID 10889393
(E,3R,4R)-4-methyl-1-phenyl-7-trimethylsilylhept-5-en-3-ol
CID 101106671
(5S,6R,7E)-5-methyl-6-phenyl-9-trimethylsilylnona-1,7-dien-4-ol
CID 11335668
(4S,5R,6E)-4-methyl-5-phenyl-8-trimethylsilylocta-1,6-dien-3-one
CID 11335171
(E)-2-methyl-1-phenyl-4-trimethylgermylbut-3-en-1-ol
CID 10707756
(E,1S,2R)-2-ethenyl-1-phenyl-7-trimethylsilylhept-5-en-1-ol;trichlorotitanium
CID 10478498
(E)-4-(benzenesulfonyl)-7-trimethylsilylhept-5-en-2-ol
CID 10806076
(1R,2R)-1,2-diphenyl-3-trimethylsilylpropan-1-ol
CID 124629266
(Z,1S,2S)-4-(methoxymethoxy)-2-methyl-1-phenylbut-3-en-1-ol
CID 134905022
(1S,2R)-2-methyl-1-phenyl-3-trimethylsilylbut-3-en-1-ol
CID 10857402
(2S)-2-methyl-1-phenyl-5-trimethylsilylpenta-3,4-dien-1-ol
CID 101067256
1,2-diphenylethane-1,2-diol
CID 159073808

Frequently Asked Questions

What is the IUPAC name of (E,1S,2R)-2-methyl-1-phenyl-5-trimethylsilylpent-3-en-1-ol?
The IUPAC name of (E,1S,2R)-2-methyl-1-phenyl-5-trimethylsilylpent-3-en-1-ol (CID 102275587) is (E,1S,2R)-2-methyl-1-phenyl-5-trimethylsilylpent-3-en-1-ol.
What is the SMILES notation for (E,1S,2R)-2-methyl-1-phenyl-5-trimethylsilylpent-3-en-1-ol?
The canonical SMILES for (E,1S,2R)-2-methyl-1-phenyl-5-trimethylsilylpent-3-en-1-ol is C[C@H](/C=C/C[Si](C)(C)C)[C@H](O)c1ccccc1.
What is the InChIKey of (E,1S,2R)-2-methyl-1-phenyl-5-trimethylsilylpent-3-en-1-ol?
The InChIKey is FZYRLBXBDBQGBE-HOMMJUPQSA-N. The full InChI is InChI=1S/C15H24OSi/c1-13(9-8-12-17(2,3)4)15(16)14-10-6-5-7-11-14/h5-11,13,15-16H,12H2,1-4H3/b9-8+/t13-,15+/m1/s1.
What are the key properties of (E,1S,2R)-2-methyl-1-phenyl-5-trimethylsilylpent-3-en-1-ol?
(E,1S,2R)-2-methyl-1-phenyl-5-trimethylsilylpent-3-en-1-ol has a molecular weight of 248.44 g/mol, XLogP of 4.25, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E,1S,2R)-2-methyl-1-phenyl-5-trimethylsilylpent-3-en-1-ol is sourced from PubChem (CID 102275587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).