[(3R)-2,5-dimethyl-3,4-diphenylcyclopentyl]oxy-trimethylsilane

C22H29OSi+ — CID 135036107

IUPAC[(3R)-2,5-dimethyl-3,4-diphenylcyclopentyl]oxy-trimethylsilane
SMILESCC1[C+](O[Si](C)(C)C)C(C)[C@H](c2ccccc2)C1c1ccccc1
InChIInChI=1S/C22H29OSi/c1-16-20(18-12-8-6-9-13-18)21(19-14-10-7-11-15-19)17(2)22(16)23-24(3,4)5/h6-17,20-21H,1-5H3/q+1/t16?,17?,20-,21?/m1/s1
InChIKeyPZJOLTXLGOQUFH-IDBGYDNBSA-N
MW337.56 g/mol
LogP6.22
Rot. Bonds4

About [(3R)-2,5-dimethyl-3,4-diphenylcyclopentyl]oxy-trimethylsilane

[(3R)-2,5-dimethyl-3,4-diphenylcyclopentyl]oxy-trimethylsilane (PubChem CID 135036107) has the molecular formula C22H29OSi+ and a molecular weight of 337.56 g/mol. Its IUPAC name is [(3R)-2,5-dimethyl-3,4-diphenylcyclopentyl]oxy-trimethylsilane.

Molecular Properties

Compound Name[(3R)-2,5-dimethyl-3,4-diphenylcyclopentyl]oxy-trimethylsilane
PubChem CID135036107
Molecular FormulaC22H29OSi+
Molecular Weight337.56 g/mol
Exact Mass337.20
IUPAC Name[(3R)-2,5-dimethyl-3,4-diphenylcyclopentyl]oxy-trimethylsilane
SMILESCC1[C+](O[Si](C)(C)C)C(C)[C@H](c2ccccc2)C1c1ccccc1
InChIInChI=1S/C22H29OSi/c1-16-20(18-12-8-6-9-13-18)21(19-14-10-7-11-15-19)17(2)22(16)23-24(3,4)5/h6-17,20-21H,1-5H3/q+1/t16?,17?,20-,21?/m1/s1
InChIKeyPZJOLTXLGOQUFH-IDBGYDNBSA-N
XLogP6.22
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500337.56
LogP ≤ 56.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(4S)-4,5-dimethyl-2-phenyl-1,3-dioxolane
CID 68508640
2-methyl-3-phenylcyclopropan-1-ol
CID 100919927
3-butyl-5-methyl-4-phenyl-4,5-dihydro-3H-pyrazole
CID 90723422
(2R)-2-methyl-3-phenyloxirane
CID 12040001
(2R,3S,4S,5R)-2,3,4,5-tetraphenyloxolane
CID 102288914
(2R,3S)-2-methyl-3-phenyloxirane
CID 6452030
7-phenyl-2,5-dioxabicyclo[4.1.0]heptane
CID 12910404
trimethyl-[(1S,4R)-2,3,5-triphenyl-4-trimethylsilylcyclopent-2-en-1-yl]silane
CID 122210293
1-[(1S,2R,3R,4S)-2,3-dimethyl-4-phenylcyclobutyl]-4-methoxybenzene
CID 134955785
(4R,6R)-4,6-dimethyl-2,5-diphenyl-1,3,2-dioxaborinane
CID 99864585
ethane;2-(3-phenyloxiran-2-yl)ethanol
CID 143522200
trans-(2S,3S)-N,N-dimethyl-2,3-diphenylcyclopropan-1-amine
CID 134994236

Frequently Asked Questions

What is the IUPAC name of [(3R)-2,5-dimethyl-3,4-diphenylcyclopentyl]oxy-trimethylsilane?
The IUPAC name of [(3R)-2,5-dimethyl-3,4-diphenylcyclopentyl]oxy-trimethylsilane (CID 135036107) is [(3R)-2,5-dimethyl-3,4-diphenylcyclopentyl]oxy-trimethylsilane.
What is the SMILES notation for [(3R)-2,5-dimethyl-3,4-diphenylcyclopentyl]oxy-trimethylsilane?
The canonical SMILES for [(3R)-2,5-dimethyl-3,4-diphenylcyclopentyl]oxy-trimethylsilane is CC1[C+](O[Si](C)(C)C)C(C)[C@H](c2ccccc2)C1c1ccccc1.
What is the InChIKey of [(3R)-2,5-dimethyl-3,4-diphenylcyclopentyl]oxy-trimethylsilane?
The InChIKey is PZJOLTXLGOQUFH-IDBGYDNBSA-N. The full InChI is InChI=1S/C22H29OSi/c1-16-20(18-12-8-6-9-13-18)21(19-14-10-7-11-15-19)17(2)22(16)23-24(3,4)5/h6-17,20-21H,1-5H3/q+1/t16?,17?,20-,21?/m1/s1.
What are the key properties of [(3R)-2,5-dimethyl-3,4-diphenylcyclopentyl]oxy-trimethylsilane?
[(3R)-2,5-dimethyl-3,4-diphenylcyclopentyl]oxy-trimethylsilane has a molecular weight of 337.56 g/mol, XLogP of 6.22, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(3R)-2,5-dimethyl-3,4-diphenylcyclopentyl]oxy-trimethylsilane is sourced from PubChem (CID 135036107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).