(2R,3S)-2-methyl-3-tri(propan-2-yl)silyloxypent-4-yn-1-ol

C15H30O2Si — CID 101145508

IUPAC(2R,3S)-2-methyl-3-tri(propan-2-yl)silyloxypent-4-yn-1-ol
SMILESC#C[C@@H](O[Si](C(C)C)(C(C)C)C(C)C)[C@H](C)CO
InChIInChI=1S/C15H30O2Si/c1-9-15(14(8)10-16)17-18(11(2)3,12(4)5)13(6)7/h1,11-16H,10H2,2-8H3/t14-,15-/m1/s1
InChIKeyIJXFFQLCVUGFHY-HUUCEWRRSA-N
MW270.49 g/mol
LogP3.81
Rot. Bonds7

About (2R,3S)-2-methyl-3-tri(propan-2-yl)silyloxypent-4-yn-1-ol

(2R,3S)-2-methyl-3-tri(propan-2-yl)silyloxypent-4-yn-1-ol (PubChem CID 101145508) has the molecular formula C15H30O2Si and a molecular weight of 270.49 g/mol. Its IUPAC name is (2R,3S)-2-methyl-3-tri(propan-2-yl)silyloxypent-4-yn-1-ol.

Molecular Properties

Compound Name(2R,3S)-2-methyl-3-tri(propan-2-yl)silyloxypent-4-yn-1-ol
PubChem CID101145508
Molecular FormulaC15H30O2Si
Molecular Weight270.49 g/mol
Exact Mass270.20
IUPAC Name(2R,3S)-2-methyl-3-tri(propan-2-yl)silyloxypent-4-yn-1-ol
SMILESC#C[C@@H](O[Si](C(C)C)(C(C)C)C(C)C)[C@H](C)CO
InChIInChI=1S/C15H30O2Si/c1-9-15(14(8)10-16)17-18(11(2)3,12(4)5)13(6)7/h1,11-16H,10H2,2-8H3/t14-,15-/m1/s1
InChIKeyIJXFFQLCVUGFHY-HUUCEWRRSA-N
XLogP3.81
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.49
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

tert-butyl (2R,3R,4S)-5-hydroxy-2,4-dimethyl-3-tri(propan-2-yl)silyloxypentanoate
CID 135012525
(4R,6S)-2,5,5-trimethyl-6-tri(propan-2-yl)silyloxyoct-7-yn-4-ol
CID 11233116
oct-1-yn-3-yloxy-tri(propan-2-yl)silane
CID 10869775
5-tri(propan-2-yl)silyloxyhept-1-en-6-yn-3-ol
CID 102108647
1-tri(propan-2-yl)silyloxybut-3-yn-2-ol
CID 102024354
1-tri(propan-2-yl)silyloxyethanol
CID 87610616
[(3R,8S,9R)-9-methoxy-8-methylundec-1-yn-3-yl]oxy-tri(propan-2-yl)silane
CID 24879566
(2R,3S)-2-methyl-3-sulfanylbutan-1-ol
CID 10154043
(3R)-2-methyl-3-sulfanylbutan-1-ol
CID 21355819
(2S)-2-methyl-3-sulfanylbutan-1-ol
CID 59085195
(2S,3S)-3-tri(propan-2-yl)silyloxybutan-2-ol
CID 11118360
4-methylhex-1-yn-3-ol
CID 64914374

Frequently Asked Questions

What is the IUPAC name of (2R,3S)-2-methyl-3-tri(propan-2-yl)silyloxypent-4-yn-1-ol?
The IUPAC name of (2R,3S)-2-methyl-3-tri(propan-2-yl)silyloxypent-4-yn-1-ol (CID 101145508) is (2R,3S)-2-methyl-3-tri(propan-2-yl)silyloxypent-4-yn-1-ol.
What is the SMILES notation for (2R,3S)-2-methyl-3-tri(propan-2-yl)silyloxypent-4-yn-1-ol?
The canonical SMILES for (2R,3S)-2-methyl-3-tri(propan-2-yl)silyloxypent-4-yn-1-ol is C#C[C@@H](O[Si](C(C)C)(C(C)C)C(C)C)[C@H](C)CO.
What is the InChIKey of (2R,3S)-2-methyl-3-tri(propan-2-yl)silyloxypent-4-yn-1-ol?
The InChIKey is IJXFFQLCVUGFHY-HUUCEWRRSA-N. The full InChI is InChI=1S/C15H30O2Si/c1-9-15(14(8)10-16)17-18(11(2)3,12(4)5)13(6)7/h1,11-16H,10H2,2-8H3/t14-,15-/m1/s1.
What are the key properties of (2R,3S)-2-methyl-3-tri(propan-2-yl)silyloxypent-4-yn-1-ol?
(2R,3S)-2-methyl-3-tri(propan-2-yl)silyloxypent-4-yn-1-ol has a molecular weight of 270.49 g/mol, XLogP of 3.81, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3S)-2-methyl-3-tri(propan-2-yl)silyloxypent-4-yn-1-ol is sourced from PubChem (CID 101145508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).