2-methyl-5-tri(propan-2-yl)silylpent-4-yn-2-ol

C15H30OSi — CID 156625822

IUPAC2-methyl-5-tri(propan-2-yl)silylpent-4-yn-2-ol
SMILESCC(C)[Si](C#CCC(C)(C)O)(C(C)C)C(C)C
InChIInChI=1S/C15H30OSi/c1-12(2)17(13(3)4,14(5)6)11-9-10-15(7,8)16/h12-14,16H,10H2,1-8H3
InChIKeyYNDCPIGSLJAWFG-UHFFFAOYSA-N
MW254.49 g/mol
LogP4.37
Rot. Bonds4

About 2-methyl-5-tri(propan-2-yl)silylpent-4-yn-2-ol

2-methyl-5-tri(propan-2-yl)silylpent-4-yn-2-ol (PubChem CID 156625822) has the molecular formula C15H30OSi and a molecular weight of 254.49 g/mol. Its IUPAC name is 2-methyl-5-tri(propan-2-yl)silylpent-4-yn-2-ol.

Molecular Properties

Compound Name2-methyl-5-tri(propan-2-yl)silylpent-4-yn-2-ol
PubChem CID156625822
Molecular FormulaC15H30OSi
Molecular Weight254.49 g/mol
Exact Mass254.21
IUPAC Name2-methyl-5-tri(propan-2-yl)silylpent-4-yn-2-ol
SMILESCC(C)[Si](C#CCC(C)(C)O)(C(C)C)C(C)C
InChIInChI=1S/C15H30OSi/c1-12(2)17(13(3)4,14(5)6)11-9-10-15(7,8)16/h12-14,16H,10H2,1-8H3
InChIKeyYNDCPIGSLJAWFG-UHFFFAOYSA-N
XLogP4.37
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.49
LogP ≤ 54.37
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 2-methyl-5-tri(propan-2-yl)silylpent-4-yn-2-ol?
The IUPAC name of 2-methyl-5-tri(propan-2-yl)silylpent-4-yn-2-ol (CID 156625822) is 2-methyl-5-tri(propan-2-yl)silylpent-4-yn-2-ol.
What is the SMILES notation for 2-methyl-5-tri(propan-2-yl)silylpent-4-yn-2-ol?
The canonical SMILES for 2-methyl-5-tri(propan-2-yl)silylpent-4-yn-2-ol is CC(C)[Si](C#CCC(C)(C)O)(C(C)C)C(C)C.
What is the InChIKey of 2-methyl-5-tri(propan-2-yl)silylpent-4-yn-2-ol?
The InChIKey is YNDCPIGSLJAWFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30OSi/c1-12(2)17(13(3)4,14(5)6)11-9-10-15(7,8)16/h12-14,16H,10H2,1-8H3.
What are the key properties of 2-methyl-5-tri(propan-2-yl)silylpent-4-yn-2-ol?
2-methyl-5-tri(propan-2-yl)silylpent-4-yn-2-ol has a molecular weight of 254.49 g/mol, XLogP of 4.37, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-tri(propan-2-yl)silylpent-4-yn-2-ol is sourced from PubChem (CID 156625822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).