[(2S,6R)-6-ethyl-4-iodo-2-methyl-3,6-dihydro-2H-pyran-5-yl]-trimethylsilane

C11H21IOSi — CID 101495840

IUPAC[(2S,6R)-6-ethyl-4-iodo-2-methyl-3,6-dihydro-2H-pyran-5-yl]-trimethylsilane
SMILESCC[C@H]1O[C@@H](C)CC(I)=C1[Si](C)(C)C
InChIInChI=1S/C11H21IOSi/c1-6-10-11(14(3,4)5)9(12)7-8(2)13-10/h8,10H,6-7H2,1-5H3/t8-,10+/m0/s1
InChIKeyIMUQBQRKUFFTFB-WCBMZHEXSA-N
MW324.28 g/mol
LogP4.14
Rot. Bonds2

About [(2S,6R)-6-ethyl-4-iodo-2-methyl-3,6-dihydro-2H-pyran-5-yl]-trimethylsilane

[(2S,6R)-6-ethyl-4-iodo-2-methyl-3,6-dihydro-2H-pyran-5-yl]-trimethylsilane (PubChem CID 101495840) has the molecular formula C11H21IOSi and a molecular weight of 324.28 g/mol. Its IUPAC name is [(2S,6R)-6-ethyl-4-iodo-2-methyl-3,6-dihydro-2H-pyran-5-yl]-trimethylsilane.

Molecular Properties

Compound Name[(2S,6R)-6-ethyl-4-iodo-2-methyl-3,6-dihydro-2H-pyran-5-yl]-trimethylsilane
PubChem CID101495840
Molecular FormulaC11H21IOSi
Molecular Weight324.28 g/mol
Exact Mass324.04
IUPAC Name[(2S,6R)-6-ethyl-4-iodo-2-methyl-3,6-dihydro-2H-pyran-5-yl]-trimethylsilane
SMILESCC[C@H]1O[C@@H](C)CC(I)=C1[Si](C)(C)C
InChIInChI=1S/C11H21IOSi/c1-6-10-11(14(3,4)5)9(12)7-8(2)13-10/h8,10H,6-7H2,1-5H3/t8-,10+/m0/s1
InChIKeyIMUQBQRKUFFTFB-WCBMZHEXSA-N
XLogP4.14
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.28
LogP ≤ 54.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

[(2S,6R)-4-iodo-2-methyl-6-pentyl-3,6-dihydro-2H-pyran-5-yl]-trimethylsilane
CID 101495835
[(2S,6R)-4-iodo-2-methyl-6-propyl-3,6-dihydro-2H-pyran-5-yl]-trimethylsilane
CID 101495836
[(2S,6R)-4-iodo-2-methyl-6-(2-methylpropyl)-3,6-dihydro-2H-pyran-5-yl]-trimethylsilane
CID 101495837
(2,6-Dimethyl-2,3,4,6-tetrahydropyran-4-ylium-5-yl)-trimethylsilane
CID 135042012
trimethyl-(2-methyl-3,6-dihydro-2H-pyran-4-yl)silane
CID 12130353

Frequently Asked Questions

What is the IUPAC name of [(2S,6R)-6-ethyl-4-iodo-2-methyl-3,6-dihydro-2H-pyran-5-yl]-trimethylsilane?
The IUPAC name of [(2S,6R)-6-ethyl-4-iodo-2-methyl-3,6-dihydro-2H-pyran-5-yl]-trimethylsilane (CID 101495840) is [(2S,6R)-6-ethyl-4-iodo-2-methyl-3,6-dihydro-2H-pyran-5-yl]-trimethylsilane.
What is the SMILES notation for [(2S,6R)-6-ethyl-4-iodo-2-methyl-3,6-dihydro-2H-pyran-5-yl]-trimethylsilane?
The canonical SMILES for [(2S,6R)-6-ethyl-4-iodo-2-methyl-3,6-dihydro-2H-pyran-5-yl]-trimethylsilane is CC[C@H]1O[C@@H](C)CC(I)=C1[Si](C)(C)C.
What is the InChIKey of [(2S,6R)-6-ethyl-4-iodo-2-methyl-3,6-dihydro-2H-pyran-5-yl]-trimethylsilane?
The InChIKey is IMUQBQRKUFFTFB-WCBMZHEXSA-N. The full InChI is InChI=1S/C11H21IOSi/c1-6-10-11(14(3,4)5)9(12)7-8(2)13-10/h8,10H,6-7H2,1-5H3/t8-,10+/m0/s1.
What are the key properties of [(2S,6R)-6-ethyl-4-iodo-2-methyl-3,6-dihydro-2H-pyran-5-yl]-trimethylsilane?
[(2S,6R)-6-ethyl-4-iodo-2-methyl-3,6-dihydro-2H-pyran-5-yl]-trimethylsilane has a molecular weight of 324.28 g/mol, XLogP of 4.14, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S,6R)-6-ethyl-4-iodo-2-methyl-3,6-dihydro-2H-pyran-5-yl]-trimethylsilane is sourced from PubChem (CID 101495840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).