1-[(2R)-2-[dimethyl(phenyl)silyl]-3-methylbut-3-enyl]cyclohexan-1-ol

C19H30OSi — CID 100920672

IUPAC1-[(2R)-2-[dimethyl(phenyl)silyl]-3-methylbut-3-enyl]cyclohexan-1-ol
SMILESC=C(C)[C@@H](CC1(O)CCCCC1)[Si](C)(C)c1ccccc1
InChIInChI=1S/C19H30OSi/c1-16(2)18(15-19(20)13-9-6-10-14-19)21(3,4)17-11-7-5-8-12-17/h5,7-8,11-12,18,20H,1,6,9-10,13-15H2,2-4H3/t18-/m1/s1
InChIKeyFPHKNIMCWXECRN-GOSISDBHSA-N
MW302.53 g/mol
LogP4.63
Rot. Bonds5

About 1-[(2R)-2-[dimethyl(phenyl)silyl]-3-methylbut-3-enyl]cyclohexan-1-ol

1-[(2R)-2-[dimethyl(phenyl)silyl]-3-methylbut-3-enyl]cyclohexan-1-ol (PubChem CID 100920672) has the molecular formula C19H30OSi and a molecular weight of 302.53 g/mol. Its IUPAC name is 1-[(2R)-2-[dimethyl(phenyl)silyl]-3-methylbut-3-enyl]cyclohexan-1-ol.

Molecular Properties

Compound Name1-[(2R)-2-[dimethyl(phenyl)silyl]-3-methylbut-3-enyl]cyclohexan-1-ol
PubChem CID100920672
Molecular FormulaC19H30OSi
Molecular Weight302.53 g/mol
Exact Mass302.21
IUPAC Name1-[(2R)-2-[dimethyl(phenyl)silyl]-3-methylbut-3-enyl]cyclohexan-1-ol
SMILESC=C(C)[C@@H](CC1(O)CCCCC1)[Si](C)(C)c1ccccc1
InChIInChI=1S/C19H30OSi/c1-16(2)18(15-19(20)13-9-6-10-14-19)21(3,4)17-11-7-5-8-12-17/h5,7-8,11-12,18,20H,1,6,9-10,13-15H2,2-4H3/t18-/m1/s1
InChIKeyFPHKNIMCWXECRN-GOSISDBHSA-N
XLogP4.63
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.53
LogP ≤ 54.63
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

1-(2-phenylpropyl)cyclopentan-1-ol
CID 173409519
1-[2-[[tert-butyl(diphenyl)silyl]methyl]prop-2-enyl]cyclopentan-1-ol
CID 101034326
2-methyl-1-(1-phenylcyclohexyl)prop-2-en-1-amine
CID 79180082
dimethyl-phenyl-[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)hex-1-en-3-yl]silane
CID 135049091
3-methyl-1-(1-phenylcyclopentyl)but-3-en-1-amine
CID 79185586
3-cyclohexylprop-1-en-2-yl-methyl-diphenylsilane
CID 122224745
1-(phenylsulfanylmethyl)cyclopentan-1-ol
CID 13448038
1,4,4-tris[dimethyl(phenyl)silyl]butan-1-ol
CID 10766972
1-[(2-phenylsulfanylethylamino)methyl]cycloheptan-1-ol
CID 60710821
2-[(1-hydroxycyclohexyl)methyl]-6-phenylpyridazin-3-one
CID 47557164
N-[1-[dimethyl(phenyl)silyl]propyl]-N-methylacetamide
CID 10857870
1-(2-benzyl-6,9-dimethyldec-8-enyl)cyclohexan-1-ol
CID 176730363

Frequently Asked Questions

What is the IUPAC name of 1-[(2R)-2-[dimethyl(phenyl)silyl]-3-methylbut-3-enyl]cyclohexan-1-ol?
The IUPAC name of 1-[(2R)-2-[dimethyl(phenyl)silyl]-3-methylbut-3-enyl]cyclohexan-1-ol (CID 100920672) is 1-[(2R)-2-[dimethyl(phenyl)silyl]-3-methylbut-3-enyl]cyclohexan-1-ol.
What is the SMILES notation for 1-[(2R)-2-[dimethyl(phenyl)silyl]-3-methylbut-3-enyl]cyclohexan-1-ol?
The canonical SMILES for 1-[(2R)-2-[dimethyl(phenyl)silyl]-3-methylbut-3-enyl]cyclohexan-1-ol is C=C(C)[C@@H](CC1(O)CCCCC1)[Si](C)(C)c1ccccc1.
What is the InChIKey of 1-[(2R)-2-[dimethyl(phenyl)silyl]-3-methylbut-3-enyl]cyclohexan-1-ol?
The InChIKey is FPHKNIMCWXECRN-GOSISDBHSA-N. The full InChI is InChI=1S/C19H30OSi/c1-16(2)18(15-19(20)13-9-6-10-14-19)21(3,4)17-11-7-5-8-12-17/h5,7-8,11-12,18,20H,1,6,9-10,13-15H2,2-4H3/t18-/m1/s1.
What are the key properties of 1-[(2R)-2-[dimethyl(phenyl)silyl]-3-methylbut-3-enyl]cyclohexan-1-ol?
1-[(2R)-2-[dimethyl(phenyl)silyl]-3-methylbut-3-enyl]cyclohexan-1-ol has a molecular weight of 302.53 g/mol, XLogP of 4.63, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2R)-2-[dimethyl(phenyl)silyl]-3-methylbut-3-enyl]cyclohexan-1-ol is sourced from PubChem (CID 100920672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).