(2S)-2-(cyclohexen-1-yl)-3-trimethylsilylpenta-3,4-dien-2-ol

C14H24OSi — CID 134963467

IUPAC(2S)-2-(cyclohexen-1-yl)-3-trimethylsilylpenta-3,4-dien-2-ol
SMILESC=C=C([C@@](C)(O)C1=CCCCC1)[Si](C)(C)C
InChIInChI=1S/C14H24OSi/c1-6-13(16(3,4)5)14(2,15)12-10-8-7-9-11-12/h10,15H,1,7-9,11H2,2-5H3/t14-/m0/s1
InChIKeyMTQNBFPIGWGMIQ-AWEZNQCLSA-N
MW236.43 g/mol
LogP3.83
Rot. Bonds3

About (2S)-2-(cyclohexen-1-yl)-3-trimethylsilylpenta-3,4-dien-2-ol

(2S)-2-(cyclohexen-1-yl)-3-trimethylsilylpenta-3,4-dien-2-ol (PubChem CID 134963467) has the molecular formula C14H24OSi and a molecular weight of 236.43 g/mol. Its IUPAC name is (2S)-2-(cyclohexen-1-yl)-3-trimethylsilylpenta-3,4-dien-2-ol.

Molecular Properties

Compound Name(2S)-2-(cyclohexen-1-yl)-3-trimethylsilylpenta-3,4-dien-2-ol
PubChem CID134963467
Molecular FormulaC14H24OSi
Molecular Weight236.43 g/mol
Exact Mass236.16
IUPAC Name(2S)-2-(cyclohexen-1-yl)-3-trimethylsilylpenta-3,4-dien-2-ol
SMILESC=C=C([C@@](C)(O)C1=CCCCC1)[Si](C)(C)C
InChIInChI=1S/C14H24OSi/c1-6-13(16(3,4)5)14(2,15)12-10-8-7-9-11-12/h10,15H,1,7-9,11H2,2-5H3/t14-/m0/s1
InChIKeyMTQNBFPIGWGMIQ-AWEZNQCLSA-N
XLogP3.83
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.43
LogP ≤ 53.83
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'}

Analyze (2S)-2-(cyclohexen-1-yl)-3-trimethylsilylpenta-3,4-dien-2-ol with MolForge

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Launch Full Analysis

Related Compounds

1-Cyclohexene-1-methanol, alpha,alpha,4-trimethyl-
CID 86752
2-(Cyclohexen-1-yl)propan-2-ol
CID 279472
2-(Cyclohexen-1-yl)pent-4-en-2-ol
CID 12024401
2-[(4R)-4-methylcyclohexen-1-yl]propan-2-ol
CID 11367124
2-(1-Cyclohexenyl)-2-butanol
CID 10125081
(1S)-1-methyl-2-pentylcyclopent-2-en-1-ol
CID 11240715
(1S)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-methylcyclohex-2-en-1-ol
CID 11514402
(3E)-2-(cyclohexen-1-yl)-3-ethyl-5-methylhexa-3,5-dien-2-ol
CID 11736152
(2S)-2-(cyclohexen-1-yl)pent-4-en-2-ol
CID 11976995
(1S)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-ethylcyclohex-2-en-1-ol
CID 12166123
3-Methyl-1-(2-methylpropyl)cyclohex-2-en-1-ol
CID 12738600
(E)-4-methyl-3-trimethylsilyldec-2-ene-1,4-diol
CID 13382779

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(cyclohexen-1-yl)-3-trimethylsilylpenta-3,4-dien-2-ol?
The IUPAC name of (2S)-2-(cyclohexen-1-yl)-3-trimethylsilylpenta-3,4-dien-2-ol (CID 134963467) is (2S)-2-(cyclohexen-1-yl)-3-trimethylsilylpenta-3,4-dien-2-ol.
What is the SMILES notation for (2S)-2-(cyclohexen-1-yl)-3-trimethylsilylpenta-3,4-dien-2-ol?
The canonical SMILES for (2S)-2-(cyclohexen-1-yl)-3-trimethylsilylpenta-3,4-dien-2-ol is C=C=C([C@@](C)(O)C1=CCCCC1)[Si](C)(C)C.
What is the InChIKey of (2S)-2-(cyclohexen-1-yl)-3-trimethylsilylpenta-3,4-dien-2-ol?
The InChIKey is MTQNBFPIGWGMIQ-AWEZNQCLSA-N. The full InChI is InChI=1S/C14H24OSi/c1-6-13(16(3,4)5)14(2,15)12-10-8-7-9-11-12/h10,15H,1,7-9,11H2,2-5H3/t14-/m0/s1.
What are the key properties of (2S)-2-(cyclohexen-1-yl)-3-trimethylsilylpenta-3,4-dien-2-ol?
(2S)-2-(cyclohexen-1-yl)-3-trimethylsilylpenta-3,4-dien-2-ol has a molecular weight of 236.43 g/mol, XLogP of 3.83, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(cyclohexen-1-yl)-3-trimethylsilylpenta-3,4-dien-2-ol is sourced from PubChem (CID 134963467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).