(E)-1-cyclohexyl-1-phenyl-3-triethylsilylpent-3-en-1-ol

C23H38OSi — CID 135061732

IUPAC(E)-1-cyclohexyl-1-phenyl-3-triethylsilylpent-3-en-1-ol
SMILESC/C=C(\CC(O)(c1ccccc1)C1CCCCC1)[Si](CC)(CC)CC
InChIInChI=1S/C23H38OSi/c1-5-22(25(6-2,7-3)8-4)19-23(24,20-15-11-9-12-16-20)21-17-13-10-14-18-21/h5,9,11-12,15-16,21,24H,6-8,10,13-14,17-19H2,1-4H3/b22-5+
InChIKeyNVJCDUGXGNYMLI-RREIPUBJSA-N
MW358.64 g/mol
LogP6.84
Rot. Bonds8

About (E)-1-cyclohexyl-1-phenyl-3-triethylsilylpent-3-en-1-ol

(E)-1-cyclohexyl-1-phenyl-3-triethylsilylpent-3-en-1-ol (PubChem CID 135061732) has the molecular formula C23H38OSi and a molecular weight of 358.64 g/mol. Its IUPAC name is (E)-1-cyclohexyl-1-phenyl-3-triethylsilylpent-3-en-1-ol.

Molecular Properties

Compound Name(E)-1-cyclohexyl-1-phenyl-3-triethylsilylpent-3-en-1-ol
PubChem CID135061732
Molecular FormulaC23H38OSi
Molecular Weight358.64 g/mol
Exact Mass358.27
IUPAC Name(E)-1-cyclohexyl-1-phenyl-3-triethylsilylpent-3-en-1-ol
SMILESC/C=C(\CC(O)(c1ccccc1)C1CCCCC1)[Si](CC)(CC)CC
InChIInChI=1S/C23H38OSi/c1-5-22(25(6-2,7-3)8-4)19-23(24,20-15-11-9-12-16-20)21-17-13-10-14-18-21/h5,9,11-12,15-16,21,24H,6-8,10,13-14,17-19H2,1-4H3/b22-5+
InChIKeyNVJCDUGXGNYMLI-RREIPUBJSA-N
XLogP6.84
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500358.64
LogP ≤ 56.84
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

(E)-1-cyclohexyl-5-methyl-1-phenyl-3-triethylsilylhex-3-en-1-ol
CID 135062450
ethyl 3-cyclohexyl-3-hydroxy-3-phenylpropanoate
CID 12565684
(1R)-1-cyclopentyl-1-phenylethane-1,2-diol;ethane
CID 142373793
1,5-dicyclohexyl-1,5-diphenylpentane-1,5-diol
CID 10717043
1-cyclohexyl-3-(1-methylpyrrolidin-1-ium-1-yl)-1-phenylpropan-1-ol
CID 22514
1-cyclohexyl-4-(dimethylamino)-1-phenylbutan-1-ol
CID 19816197
5-cyclohexyl-5-hydroxy-5-phenylpent-2-enoic acid
CID 71390062
1-cyclohexyl-2-(4,4-dimethylpiperazin-4-ium-1-yl)-1-phenylethanol iodide
CID 169441280
4-cyclohexyl-4-hydroxy-4-phenylbutanenitrile
CID 22155872
1-cyclohexyl-2-(4-methyl-4-silylpiperazin-4-ium-1-yl)-1-phenylethanol
CID 123770807
1-cyclohexyl-5-(diethylamino)-1-phenylpent-3-yn-1-ol chloride
CID 53350693
2-cyclohexyl-2-methyl-1,1-diphenylbutan-1-ol
CID 4068699

Frequently Asked Questions

What is the IUPAC name of (E)-1-cyclohexyl-1-phenyl-3-triethylsilylpent-3-en-1-ol?
The IUPAC name of (E)-1-cyclohexyl-1-phenyl-3-triethylsilylpent-3-en-1-ol (CID 135061732) is (E)-1-cyclohexyl-1-phenyl-3-triethylsilylpent-3-en-1-ol.
What is the SMILES notation for (E)-1-cyclohexyl-1-phenyl-3-triethylsilylpent-3-en-1-ol?
The canonical SMILES for (E)-1-cyclohexyl-1-phenyl-3-triethylsilylpent-3-en-1-ol is C/C=C(\CC(O)(c1ccccc1)C1CCCCC1)[Si](CC)(CC)CC.
What is the InChIKey of (E)-1-cyclohexyl-1-phenyl-3-triethylsilylpent-3-en-1-ol?
The InChIKey is NVJCDUGXGNYMLI-RREIPUBJSA-N. The full InChI is InChI=1S/C23H38OSi/c1-5-22(25(6-2,7-3)8-4)19-23(24,20-15-11-9-12-16-20)21-17-13-10-14-18-21/h5,9,11-12,15-16,21,24H,6-8,10,13-14,17-19H2,1-4H3/b22-5+.
What are the key properties of (E)-1-cyclohexyl-1-phenyl-3-triethylsilylpent-3-en-1-ol?
(E)-1-cyclohexyl-1-phenyl-3-triethylsilylpent-3-en-1-ol has a molecular weight of 358.64 g/mol, XLogP of 6.84, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-cyclohexyl-1-phenyl-3-triethylsilylpent-3-en-1-ol is sourced from PubChem (CID 135061732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).