1-[(1R,2S)-2-phenyl-1-trimethylsilylcyclopropyl]ethanol

C14H22OSi — CID 102252697

IUPAC1-[(1R,2S)-2-phenyl-1-trimethylsilylcyclopropyl]ethanol
SMILESCC(O)[C@@]1([Si](C)(C)C)C[C@H]1c1ccccc1
InChIInChI=1S/C14H22OSi/c1-11(15)14(16(2,3)4)10-13(14)12-8-6-5-7-9-12/h5-9,11,13,15H,10H2,1-4H3/t11?,13-,14-/m0/s1
InChIKeyAFNOAXMJDLGWRK-VNXPTHQBSA-N
MW234.41 g/mol
LogP3.63
Rot. Bonds3

About 1-[(1R,2S)-2-phenyl-1-trimethylsilylcyclopropyl]ethanol

1-[(1R,2S)-2-phenyl-1-trimethylsilylcyclopropyl]ethanol (PubChem CID 102252697) has the molecular formula C14H22OSi and a molecular weight of 234.41 g/mol. Its IUPAC name is 1-[(1R,2S)-2-phenyl-1-trimethylsilylcyclopropyl]ethanol.

Molecular Properties

Compound Name1-[(1R,2S)-2-phenyl-1-trimethylsilylcyclopropyl]ethanol
PubChem CID102252697
Molecular FormulaC14H22OSi
Molecular Weight234.41 g/mol
Exact Mass234.14
IUPAC Name1-[(1R,2S)-2-phenyl-1-trimethylsilylcyclopropyl]ethanol
SMILESCC(O)[C@@]1([Si](C)(C)C)C[C@H]1c1ccccc1
InChIInChI=1S/C14H22OSi/c1-11(15)14(16(2,3)4)10-13(14)12-8-6-5-7-9-12/h5-9,11,13,15H,10H2,1-4H3/t11?,13-,14-/m0/s1
InChIKeyAFNOAXMJDLGWRK-VNXPTHQBSA-N
XLogP3.63
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.41
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-[1-(1-carboxyethyl)-2-phenylcyclopropyl]propanoic acid
CID 70602858
trans-(1S,2S)-2-phenyl-1-propan-2-ylcyclopropan-1-amine
CID 90206365
trans-methyl (1S,2R)-2-phenyl-1-trimethylsilylcyclopropane-1-carboxylate
CID 44612781
2-phenyl-1-propan-2-ylcyclopropan-1-amine;hydrochloride
CID 90197722
(2R)-1-[[(1S,3S)-2,2-dimethyl-3-phenylcyclobutyl]amino]propan-2-ol
CID 99603211
trans-(1S,2R)-1-[[(2S)-2-hydroxypropanoyl]amino]-2-phenylcyclopropane-1-carboxylic acid
CID 176961744
[(2R)-2-bromo-2-methylcyclopropyl]benzene
CID 166445339
[(1R,2S)-1-methyl-2-phenylcyclopropyl]methanol
CID 10607081
trans-(1S,2R)-1-methyl-2-phenyl-N,N-di(propan-2-yl)cyclopropane-1-carboxamide
CID 102327290
trans-methyl (1S,2R)-2-phenyl-1-tri(propan-2-yl)silylcyclopropane-1-carboxylate
CID 102019751
trans-(1S,2S)-1-(2-methylpropyl)-2-phenylcyclopropan-1-amine
CID 178202513
1-(2-methylpropyl)-2-phenylcyclopropan-1-amine
CID 84662303

Frequently Asked Questions

What is the IUPAC name of 1-[(1R,2S)-2-phenyl-1-trimethylsilylcyclopropyl]ethanol?
The IUPAC name of 1-[(1R,2S)-2-phenyl-1-trimethylsilylcyclopropyl]ethanol (CID 102252697) is 1-[(1R,2S)-2-phenyl-1-trimethylsilylcyclopropyl]ethanol.
What is the SMILES notation for 1-[(1R,2S)-2-phenyl-1-trimethylsilylcyclopropyl]ethanol?
The canonical SMILES for 1-[(1R,2S)-2-phenyl-1-trimethylsilylcyclopropyl]ethanol is CC(O)[C@@]1([Si](C)(C)C)C[C@H]1c1ccccc1.
What is the InChIKey of 1-[(1R,2S)-2-phenyl-1-trimethylsilylcyclopropyl]ethanol?
The InChIKey is AFNOAXMJDLGWRK-VNXPTHQBSA-N. The full InChI is InChI=1S/C14H22OSi/c1-11(15)14(16(2,3)4)10-13(14)12-8-6-5-7-9-12/h5-9,11,13,15H,10H2,1-4H3/t11?,13-,14-/m0/s1.
What are the key properties of 1-[(1R,2S)-2-phenyl-1-trimethylsilylcyclopropyl]ethanol?
1-[(1R,2S)-2-phenyl-1-trimethylsilylcyclopropyl]ethanol has a molecular weight of 234.41 g/mol, XLogP of 3.63, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1R,2S)-2-phenyl-1-trimethylsilylcyclopropyl]ethanol is sourced from PubChem (CID 102252697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).