(1S)-1-naphthalen-2-yl-3-trimethylsilylprop-2-yn-1-ol

C16H18OSi — CID 24851555

IUPAC(1S)-1-naphthalen-2-yl-3-trimethylsilylprop-2-yn-1-ol
SMILESC[Si](C)(C)C#C[C@@H](O)c1ccc2ccccc2c1
InChIInChI=1S/C16H18OSi/c1-18(2,3)11-10-16(17)15-9-8-13-6-4-5-7-14(13)12-15/h4-9,12,16-17H,1-3H3/t16-/m1/s1
InChIKeyKYAGKYRLOBBLLH-MRXNPFEDSA-N
MW254.41 g/mol
LogP3.75
Rot. Bonds1

About (1S)-1-naphthalen-2-yl-3-trimethylsilylprop-2-yn-1-ol

(1S)-1-naphthalen-2-yl-3-trimethylsilylprop-2-yn-1-ol (PubChem CID 24851555) has the molecular formula C16H18OSi and a molecular weight of 254.41 g/mol. Its IUPAC name is (1S)-1-naphthalen-2-yl-3-trimethylsilylprop-2-yn-1-ol.

Molecular Properties

Compound Name(1S)-1-naphthalen-2-yl-3-trimethylsilylprop-2-yn-1-ol
PubChem CID24851555
Molecular FormulaC16H18OSi
Molecular Weight254.41 g/mol
Exact Mass254.11
IUPAC Name(1S)-1-naphthalen-2-yl-3-trimethylsilylprop-2-yn-1-ol
SMILESC[Si](C)(C)C#C[C@@H](O)c1ccc2ccccc2c1
InChIInChI=1S/C16H18OSi/c1-18(2,3)11-10-16(17)15-9-8-13-6-4-5-7-14(13)12-15/h4-9,12,16-17H,1-3H3/t16-/m1/s1
InChIKeyKYAGKYRLOBBLLH-MRXNPFEDSA-N
XLogP3.75
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.41
LogP ≤ 53.75
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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Related Compounds

1-naphthalen-2-ylbut-2-yne-1,4-diol
CID 46914649
1-(3-methoxyphenyl)-3-trimethylsilylprop-2-yn-1-ol
CID 15531429
amino(naphthalen-2-yl)methanol
CID 57110079
naphthalen-2-ylmethanediol
CID 22496827
1-(4-methylsulfanylphenyl)-3-trimethylsilylprop-2-yn-1-ol
CID 67313902
[(6R)-6-hydroxy-6-naphthalen-2-ylhexa-2,4-diynyl] acetate
CID 102291904
(1,2-dinaphthalen-2-yl-2-trimethylsilyloxyethoxy)-trimethylsilane
CID 10575884
trimethyl(2-naphthalen-2-ylethynyl)silane
CID 12579656
4-(4-methylphenyl)sulfonyl-1-naphthalen-2-ylbut-2-yn-1-ol
CID 101160197
ethane;2-propan-2-ylnaphthalene
CID 142226111
ethane;1-naphthalen-2-ylpropan-1-ol
CID 143858826
(2S,3R)-2-hydroxy-3-naphthalen-2-ylbutanenitrile
CID 100997633

Frequently Asked Questions

What is the IUPAC name of (1S)-1-naphthalen-2-yl-3-trimethylsilylprop-2-yn-1-ol?
The IUPAC name of (1S)-1-naphthalen-2-yl-3-trimethylsilylprop-2-yn-1-ol (CID 24851555) is (1S)-1-naphthalen-2-yl-3-trimethylsilylprop-2-yn-1-ol.
What is the SMILES notation for (1S)-1-naphthalen-2-yl-3-trimethylsilylprop-2-yn-1-ol?
The canonical SMILES for (1S)-1-naphthalen-2-yl-3-trimethylsilylprop-2-yn-1-ol is C[Si](C)(C)C#C[C@@H](O)c1ccc2ccccc2c1.
What is the InChIKey of (1S)-1-naphthalen-2-yl-3-trimethylsilylprop-2-yn-1-ol?
The InChIKey is KYAGKYRLOBBLLH-MRXNPFEDSA-N. The full InChI is InChI=1S/C16H18OSi/c1-18(2,3)11-10-16(17)15-9-8-13-6-4-5-7-14(13)12-15/h4-9,12,16-17H,1-3H3/t16-/m1/s1.
What are the key properties of (1S)-1-naphthalen-2-yl-3-trimethylsilylprop-2-yn-1-ol?
(1S)-1-naphthalen-2-yl-3-trimethylsilylprop-2-yn-1-ol has a molecular weight of 254.41 g/mol, XLogP of 3.75, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-naphthalen-2-yl-3-trimethylsilylprop-2-yn-1-ol is sourced from PubChem (CID 24851555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).