trans-(1R,2S)-1-[2-[dimethyl(phenyl)silyl]prop-2-enyl]-2-methyl-4-methylidenecyclopentan-1-ol

C18H26OSi — CID 11323644

IUPACtrans-(1R,2S)-1-[2-[dimethyl(phenyl)silyl]prop-2-enyl]-2-methyl-4-methylidenecyclopentan-1-ol
SMILESC=C1C[C@H](C)[C@](O)(CC(=C)[Si](C)(C)c2ccccc2)C1
InChIInChI=1S/C18H26OSi/c1-14-11-15(2)18(19,12-14)13-16(3)20(4,5)17-9-7-6-8-10-17/h6-10,15,19H,1,3,11-13H2,2,4-5H3/t15-,18+/m0/s1
InChIKeyZMXABZKXXLAPJE-MAUKXSAKSA-N
MW286.49 g/mol
LogP3.80
Rot. Bonds4

About trans-(1R,2S)-1-[2-[dimethyl(phenyl)silyl]prop-2-enyl]-2-methyl-4-methylidenecyclopentan-1-ol

trans-(1R,2S)-1-[2-[dimethyl(phenyl)silyl]prop-2-enyl]-2-methyl-4-methylidenecyclopentan-1-ol (PubChem CID 11323644) has the molecular formula C18H26OSi and a molecular weight of 286.49 g/mol. Its IUPAC name is trans-(1R,2S)-1-[2-[dimethyl(phenyl)silyl]prop-2-enyl]-2-methyl-4-methylidenecyclopentan-1-ol.

Molecular Properties

Compound Nametrans-(1R,2S)-1-[2-[dimethyl(phenyl)silyl]prop-2-enyl]-2-methyl-4-methylidenecyclopentan-1-ol
PubChem CID11323644
Molecular FormulaC18H26OSi
Molecular Weight286.49 g/mol
Exact Mass286.18
IUPAC Nametrans-(1R,2S)-1-[2-[dimethyl(phenyl)silyl]prop-2-enyl]-2-methyl-4-methylidenecyclopentan-1-ol
SMILESC=C1C[C@H](C)[C@](O)(CC(=C)[Si](C)(C)c2ccccc2)C1
InChIInChI=1S/C18H26OSi/c1-14-11-15(2)18(19,12-14)13-16(3)20(4,5)17-9-7-6-8-10-17/h6-10,15,19H,1,3,11-13H2,2,4-5H3/t15-,18+/m0/s1
InChIKeyZMXABZKXXLAPJE-MAUKXSAKSA-N
XLogP3.80
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.49
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

dimethyl-[3-(1-methylcyclohex-2-en-1-yl)prop-1-en-2-yl]-phenylsilane
CID 139263773
dimethyl-phenyl-[(4R)-4-(4-phenylphenyl)pent-1-en-2-yl]silane
CID 134955819
3-cyclohexylprop-1-en-2-yl-methyl-diphenylsilane
CID 122224745
ethyl 3-[dimethyl(phenyl)silyl]but-3-enoate
CID 134967582
dec-1-en-5-yn-2-yl-dimethyl-phenylsilane
CID 86003298
dimethyl-phenyl-(3,3,3-trifluoroprop-1-en-2-yl)silane
CID 11401963
2-iodoprop-2-enyl-dimethyl-phenylsilane
CID 14028568
(1S,4S,6R,7S,11S)-10-[(2R)-4-[dimethyl(phenyl)silyl]-2-(2-methyloxiran-2-yl)pent-4-enyl]-6-hydroxy-6-methyl-3-oxatricyclo[5.3.1.04,11]undec-9-ene-2,8-dione
CID 155933435
[cyclopropyl(sulfinyl)methyl]-dimethyl-phenylsilane
CID 10466662
cyclopropyl-[dimethyl(phenyl)silyl]methanethione
CID 10104902
(1S)-3-[dimethyl(phenyl)silyl]-1-[4-(trifluoromethyl)phenyl]but-3-en-1-ol
CID 10689220
(4-cyclopentyl-2-methylidenebutyl)-methyl-diphenylsilane
CID 162694845

Frequently Asked Questions

What is the IUPAC name of trans-(1R,2S)-1-[2-[dimethyl(phenyl)silyl]prop-2-enyl]-2-methyl-4-methylidenecyclopentan-1-ol?
The IUPAC name of trans-(1R,2S)-1-[2-[dimethyl(phenyl)silyl]prop-2-enyl]-2-methyl-4-methylidenecyclopentan-1-ol (CID 11323644) is trans-(1R,2S)-1-[2-[dimethyl(phenyl)silyl]prop-2-enyl]-2-methyl-4-methylidenecyclopentan-1-ol.
What is the SMILES notation for trans-(1R,2S)-1-[2-[dimethyl(phenyl)silyl]prop-2-enyl]-2-methyl-4-methylidenecyclopentan-1-ol?
The canonical SMILES for trans-(1R,2S)-1-[2-[dimethyl(phenyl)silyl]prop-2-enyl]-2-methyl-4-methylidenecyclopentan-1-ol is C=C1C[C@H](C)[C@](O)(CC(=C)[Si](C)(C)c2ccccc2)C1.
What is the InChIKey of trans-(1R,2S)-1-[2-[dimethyl(phenyl)silyl]prop-2-enyl]-2-methyl-4-methylidenecyclopentan-1-ol?
The InChIKey is ZMXABZKXXLAPJE-MAUKXSAKSA-N. The full InChI is InChI=1S/C18H26OSi/c1-14-11-15(2)18(19,12-14)13-16(3)20(4,5)17-9-7-6-8-10-17/h6-10,15,19H,1,3,11-13H2,2,4-5H3/t15-,18+/m0/s1.
What are the key properties of trans-(1R,2S)-1-[2-[dimethyl(phenyl)silyl]prop-2-enyl]-2-methyl-4-methylidenecyclopentan-1-ol?
trans-(1R,2S)-1-[2-[dimethyl(phenyl)silyl]prop-2-enyl]-2-methyl-4-methylidenecyclopentan-1-ol has a molecular weight of 286.49 g/mol, XLogP of 3.80, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(1R,2S)-1-[2-[dimethyl(phenyl)silyl]prop-2-enyl]-2-methyl-4-methylidenecyclopentan-1-ol is sourced from PubChem (CID 11323644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).