[(1S,2S)-1-methoxy-2-phenyl-2-propan-2-ylcyclopropyl]oxy-trimethylsilane

C16H26O2Si — CID 10378846

IUPAC[(1S,2S)-1-methoxy-2-phenyl-2-propan-2-ylcyclopropyl]oxy-trimethylsilane
SMILESCO[C@]1(O[Si](C)(C)C)C[C@@]1(c1ccccc1)C(C)C
InChIInChI=1S/C16H26O2Si/c1-13(2)15(14-10-8-7-9-11-14)12-16(15,17-3)18-19(4,5)6/h7-11,13H,12H2,1-6H3/t15-,16-/m0/s1
InChIKeyCCGOEBAQGQMAIA-HOTGVXAUSA-N
MW278.47 g/mol
LogP4.18
Rot. Bonds5

About [(1S,2S)-1-methoxy-2-phenyl-2-propan-2-ylcyclopropyl]oxy-trimethylsilane

[(1S,2S)-1-methoxy-2-phenyl-2-propan-2-ylcyclopropyl]oxy-trimethylsilane (PubChem CID 10378846) has the molecular formula C16H26O2Si and a molecular weight of 278.47 g/mol. Its IUPAC name is [(1S,2S)-1-methoxy-2-phenyl-2-propan-2-ylcyclopropyl]oxy-trimethylsilane.

Molecular Properties

Compound Name[(1S,2S)-1-methoxy-2-phenyl-2-propan-2-ylcyclopropyl]oxy-trimethylsilane
PubChem CID10378846
Molecular FormulaC16H26O2Si
Molecular Weight278.47 g/mol
Exact Mass278.17
IUPAC Name[(1S,2S)-1-methoxy-2-phenyl-2-propan-2-ylcyclopropyl]oxy-trimethylsilane
SMILESCO[C@]1(O[Si](C)(C)C)C[C@@]1(c1ccccc1)C(C)C
InChIInChI=1S/C16H26O2Si/c1-13(2)15(14-10-8-7-9-11-14)12-16(15,17-3)18-19(4,5)6/h7-11,13H,12H2,1-6H3/t15-,16-/m0/s1
InChIKeyCCGOEBAQGQMAIA-HOTGVXAUSA-N
XLogP4.18
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.47
LogP ≤ 54.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

cis-(1R,2S)-2-phenyl-1-propan-2-yl-2-trimethylsilyloxycyclopropan-1-ol
CID 10956424
trimethyl-[(1R,2R)-1-methyl-2-phenyl-2-trimethylsilyloxycyclopropyl]oxysilane
CID 102015524
2,2-diphenyl-1-trimethylsilyloxycyclopropane-1-carbonitrile
CID 13199261
ethane;4-methoxy-4-phenylpiperidine
CID 144662797
N-methyl-1-(2-phenylspiro[2.5]octan-2-yl)ethanamine
CID 70658565
(1-methoxy-2-phenyl-1-trimethylsilyloxy-5,6,7,8-tetrahydro-3H-pyrrolizin-2-yl)oxy-trimethylsilane
CID 101400716
5-phenyl-5-propan-2-yl-4H-1,2-oxazole
CID 173107234
2-phenyl-2-propan-2-yl-1,3-dioxane
CID 89439443
4-methoxy-4-phenyloxane
CID 21049814
[2,2-dichloro-1-(diethoxymethyl)cyclopropyl]benzene
CID 14924955
5-methoxy-2,2-dimethyl-5-phenyl-1,3-dioxane
CID 15341678
2,5-dimethyl-5-phenyl-2-propan-2-ylmorpholine
CID 105058753

Frequently Asked Questions

What is the IUPAC name of [(1S,2S)-1-methoxy-2-phenyl-2-propan-2-ylcyclopropyl]oxy-trimethylsilane?
The IUPAC name of [(1S,2S)-1-methoxy-2-phenyl-2-propan-2-ylcyclopropyl]oxy-trimethylsilane (CID 10378846) is [(1S,2S)-1-methoxy-2-phenyl-2-propan-2-ylcyclopropyl]oxy-trimethylsilane.
What is the SMILES notation for [(1S,2S)-1-methoxy-2-phenyl-2-propan-2-ylcyclopropyl]oxy-trimethylsilane?
The canonical SMILES for [(1S,2S)-1-methoxy-2-phenyl-2-propan-2-ylcyclopropyl]oxy-trimethylsilane is CO[C@]1(O[Si](C)(C)C)C[C@@]1(c1ccccc1)C(C)C.
What is the InChIKey of [(1S,2S)-1-methoxy-2-phenyl-2-propan-2-ylcyclopropyl]oxy-trimethylsilane?
The InChIKey is CCGOEBAQGQMAIA-HOTGVXAUSA-N. The full InChI is InChI=1S/C16H26O2Si/c1-13(2)15(14-10-8-7-9-11-14)12-16(15,17-3)18-19(4,5)6/h7-11,13H,12H2,1-6H3/t15-,16-/m0/s1.
What are the key properties of [(1S,2S)-1-methoxy-2-phenyl-2-propan-2-ylcyclopropyl]oxy-trimethylsilane?
[(1S,2S)-1-methoxy-2-phenyl-2-propan-2-ylcyclopropyl]oxy-trimethylsilane has a molecular weight of 278.47 g/mol, XLogP of 4.18, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(1S,2S)-1-methoxy-2-phenyl-2-propan-2-ylcyclopropyl]oxy-trimethylsilane is sourced from PubChem (CID 10378846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).