(1R)-1-cyclohexyl-3-triethylsilylprop-2-yn-1-ol

C15H28OSi — CID 10125283

IUPAC(1R)-1-cyclohexyl-3-triethylsilylprop-2-yn-1-ol
SMILESCC[Si](C#C[C@H](O)C1CCCCC1)(CC)CC
InChIInChI=1S/C15H28OSi/c1-4-17(5-2,6-3)13-12-15(16)14-10-8-7-9-11-14/h14-16H,4-11H2,1-3H3/t15-/m0/s1
InChIKeyKESZZDWKWJONLR-HNNXBMFYSA-N
MW252.47 g/mol
LogP3.98
Rot. Bonds4

About (1R)-1-cyclohexyl-3-triethylsilylprop-2-yn-1-ol

(1R)-1-cyclohexyl-3-triethylsilylprop-2-yn-1-ol (PubChem CID 10125283) has the molecular formula C15H28OSi and a molecular weight of 252.47 g/mol. Its IUPAC name is (1R)-1-cyclohexyl-3-triethylsilylprop-2-yn-1-ol.

Molecular Properties

Compound Name(1R)-1-cyclohexyl-3-triethylsilylprop-2-yn-1-ol
PubChem CID10125283
Molecular FormulaC15H28OSi
Molecular Weight252.47 g/mol
Exact Mass252.19
IUPAC Name(1R)-1-cyclohexyl-3-triethylsilylprop-2-yn-1-ol
SMILESCC[Si](C#C[C@H](O)C1CCCCC1)(CC)CC
InChIInChI=1S/C15H28OSi/c1-4-17(5-2,6-3)13-12-15(16)14-10-8-7-9-11-14/h14-16H,4-11H2,1-3H3/t15-/m0/s1
InChIKeyKESZZDWKWJONLR-HNNXBMFYSA-N
XLogP3.98
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.47
LogP ≤ 53.98
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 (1R)-1-cyclohexyl-3-triethylsilylprop-2-yn-1-ol?
The IUPAC name of (1R)-1-cyclohexyl-3-triethylsilylprop-2-yn-1-ol (CID 10125283) is (1R)-1-cyclohexyl-3-triethylsilylprop-2-yn-1-ol.
What is the SMILES notation for (1R)-1-cyclohexyl-3-triethylsilylprop-2-yn-1-ol?
The canonical SMILES for (1R)-1-cyclohexyl-3-triethylsilylprop-2-yn-1-ol is CC[Si](C#C[C@H](O)C1CCCCC1)(CC)CC.
What is the InChIKey of (1R)-1-cyclohexyl-3-triethylsilylprop-2-yn-1-ol?
The InChIKey is KESZZDWKWJONLR-HNNXBMFYSA-N. The full InChI is InChI=1S/C15H28OSi/c1-4-17(5-2,6-3)13-12-15(16)14-10-8-7-9-11-14/h14-16H,4-11H2,1-3H3/t15-/m0/s1.
What are the key properties of (1R)-1-cyclohexyl-3-triethylsilylprop-2-yn-1-ol?
(1R)-1-cyclohexyl-3-triethylsilylprop-2-yn-1-ol has a molecular weight of 252.47 g/mol, XLogP of 3.98, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-cyclohexyl-3-triethylsilylprop-2-yn-1-ol is sourced from PubChem (CID 10125283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).