1-[(E)-2-(benzenesulfonyl)ethenyl]cyclohexan-1-ol

C14H18O3S — CID 14785612

IUPAC1-[(E)-2-(benzenesulfonyl)ethenyl]cyclohexan-1-ol
SMILESO=S(=O)(/C=C/C1(O)CCCCC1)c1ccccc1
InChIInChI=1S/C14H18O3S/c15-14(9-5-2-6-10-14)11-12-18(16,17)13-7-3-1-4-8-13/h1,3-4,7-8,11-12,15H,2,5-6,9-10H2/b12-11+
InChIKeyKFIFLSDMDGQPEO-VAWYXSNFSA-N
MW266.36 g/mol
LogP2.67
Rot. Bonds3

About 1-[(E)-2-(benzenesulfonyl)ethenyl]cyclohexan-1-ol

1-[(E)-2-(benzenesulfonyl)ethenyl]cyclohexan-1-ol (PubChem CID 14785612) has the molecular formula C14H18O3S and a molecular weight of 266.36 g/mol. Its IUPAC name is 1-[(E)-2-(benzenesulfonyl)ethenyl]cyclohexan-1-ol.

Molecular Properties

Compound Name1-[(E)-2-(benzenesulfonyl)ethenyl]cyclohexan-1-ol
PubChem CID14785612
Molecular FormulaC14H18O3S
Molecular Weight266.36 g/mol
Exact Mass266.10
IUPAC Name1-[(E)-2-(benzenesulfonyl)ethenyl]cyclohexan-1-ol
SMILESO=S(=O)(/C=C/C1(O)CCCCC1)c1ccccc1
InChIInChI=1S/C14H18O3S/c15-14(9-5-2-6-10-14)11-12-18(16,17)13-7-3-1-4-8-13/h1,3-4,7-8,11-12,15H,2,5-6,9-10H2/b12-11+
InChIKeyKFIFLSDMDGQPEO-VAWYXSNFSA-N
XLogP2.67
TPSA54.37 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.36
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[(E)-2-(benzenesulfonyl)ethenyl]cyclohexan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(benzenesulfonyl)-N-cyclohexylprop-2-enamide
CID 76873750
3-(benzenesulfonyl)prop-2-enamide;dihydrochloride
CID 129105097
1-[(E)-3-triphenylstannylprop-1-enyl]cyclohexan-1-ol
CID 11134709
1-[(E)-2-dibenzylphosphorylethenyl]cyclohexan-1-ol
CID 15981536
(E)-3-(benzenesulfonyl)prop-2-enoic acid;pentahydrate
CID 19831534
[1-(benzenesulfonyl)cyclopentyl]sulfonylbenzene
CID 1380165
1-(benzenesulfonyl)cyclopropan-1-ol
CID 24799052
2-(benzenesulfonyl)ethene-1,1-diamine
CID 21311523
[(E)-2-(benzenesulfonyl)ethenyl]benzene
CID 736143
cis-(1R,2S)-2-(benzenesulfonyl)-1,2-dimethylcyclohexan-1-ol
CID 899860
2-[(Z)-2-(1-hydroxycyclopentyl)ethenyl]phenol
CID 10954674
1-amino-N-(benzenesulfonyl)cyclohexane-1-carboxamide
CID 103308699

Frequently Asked Questions

What is the IUPAC name of 1-[(E)-2-(benzenesulfonyl)ethenyl]cyclohexan-1-ol?
The IUPAC name of 1-[(E)-2-(benzenesulfonyl)ethenyl]cyclohexan-1-ol (CID 14785612) is 1-[(E)-2-(benzenesulfonyl)ethenyl]cyclohexan-1-ol.
What is the SMILES notation for 1-[(E)-2-(benzenesulfonyl)ethenyl]cyclohexan-1-ol?
The canonical SMILES for 1-[(E)-2-(benzenesulfonyl)ethenyl]cyclohexan-1-ol is O=S(=O)(/C=C/C1(O)CCCCC1)c1ccccc1.
What is the InChIKey of 1-[(E)-2-(benzenesulfonyl)ethenyl]cyclohexan-1-ol?
The InChIKey is KFIFLSDMDGQPEO-VAWYXSNFSA-N. The full InChI is InChI=1S/C14H18O3S/c15-14(9-5-2-6-10-14)11-12-18(16,17)13-7-3-1-4-8-13/h1,3-4,7-8,11-12,15H,2,5-6,9-10H2/b12-11+.
What are the key properties of 1-[(E)-2-(benzenesulfonyl)ethenyl]cyclohexan-1-ol?
1-[(E)-2-(benzenesulfonyl)ethenyl]cyclohexan-1-ol has a molecular weight of 266.36 g/mol, XLogP of 2.67, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(E)-2-(benzenesulfonyl)ethenyl]cyclohexan-1-ol is sourced from PubChem (CID 14785612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).