(2R)-2-phenyl-5-trimethylsilylpent-4-yn-2-ol

C14H20OSi — CID 134964720

IUPAC(2R)-2-phenyl-5-trimethylsilylpent-4-yn-2-ol
SMILESC[C@@](O)(CC#C[Si](C)(C)C)c1ccccc1
InChIInChI=1S/C14H20OSi/c1-14(15,11-8-12-16(2,3)4)13-9-6-5-7-10-13/h5-7,9-10,15H,11H2,1-4H3/t14-/m1/s1
InChIKeyWRJZRANAMDPBNI-CQSZACIVSA-N
MW232.40 g/mol
LogP3.16
Rot. Bonds2

About (2R)-2-phenyl-5-trimethylsilylpent-4-yn-2-ol

(2R)-2-phenyl-5-trimethylsilylpent-4-yn-2-ol (PubChem CID 134964720) has the molecular formula C14H20OSi and a molecular weight of 232.40 g/mol. Its IUPAC name is (2R)-2-phenyl-5-trimethylsilylpent-4-yn-2-ol.

Molecular Properties

Compound Name(2R)-2-phenyl-5-trimethylsilylpent-4-yn-2-ol
PubChem CID134964720
Molecular FormulaC14H20OSi
Molecular Weight232.40 g/mol
Exact Mass232.13
IUPAC Name(2R)-2-phenyl-5-trimethylsilylpent-4-yn-2-ol
SMILESC[C@@](O)(CC#C[Si](C)(C)C)c1ccccc1
InChIInChI=1S/C14H20OSi/c1-14(15,11-8-12-16(2,3)4)13-9-6-5-7-10-13/h5-7,9-10,15H,11H2,1-4H3/t14-/m1/s1
InChIKeyWRJZRANAMDPBNI-CQSZACIVSA-N
XLogP3.16
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.40
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-phenyl-5-trimethylsilylpent-4-yn-2-ol?
The IUPAC name of (2R)-2-phenyl-5-trimethylsilylpent-4-yn-2-ol (CID 134964720) is (2R)-2-phenyl-5-trimethylsilylpent-4-yn-2-ol.
What is the SMILES notation for (2R)-2-phenyl-5-trimethylsilylpent-4-yn-2-ol?
The canonical SMILES for (2R)-2-phenyl-5-trimethylsilylpent-4-yn-2-ol is C[C@@](O)(CC#C[Si](C)(C)C)c1ccccc1.
What is the InChIKey of (2R)-2-phenyl-5-trimethylsilylpent-4-yn-2-ol?
The InChIKey is WRJZRANAMDPBNI-CQSZACIVSA-N. The full InChI is InChI=1S/C14H20OSi/c1-14(15,11-8-12-16(2,3)4)13-9-6-5-7-10-13/h5-7,9-10,15H,11H2,1-4H3/t14-/m1/s1.
What are the key properties of (2R)-2-phenyl-5-trimethylsilylpent-4-yn-2-ol?
(2R)-2-phenyl-5-trimethylsilylpent-4-yn-2-ol has a molecular weight of 232.40 g/mol, XLogP of 3.16, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-phenyl-5-trimethylsilylpent-4-yn-2-ol is sourced from PubChem (CID 134964720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).