(2R,4S,6S)-2-[(Z)-2-cyclohexyloxyethenyl]-6-ethenyloxan-4-ol

C15H24O3 — CID 102291858

IUPAC(2R,4S,6S)-2-[(Z)-2-cyclohexyloxyethenyl]-6-ethenyloxan-4-ol
SMILESC=C[C@@H]1C[C@H](O)C[C@H](/C=C\OC2CCCCC2)O1
InChIInChI=1S/C15H24O3/c1-2-13-10-12(16)11-15(18-13)8-9-17-14-6-4-3-5-7-14/h2,8-9,12-16H,1,3-7,10-11H2/b9-8-/t12-,13+,15-/m0/s1
InChIKeyCZBPKOXIEHCNIS-RJQMRXGRSA-N
MW252.35 g/mol
LogP2.94
Rot. Bonds4

About (2R,4S,6S)-2-[(Z)-2-cyclohexyloxyethenyl]-6-ethenyloxan-4-ol

(2R,4S,6S)-2-[(Z)-2-cyclohexyloxyethenyl]-6-ethenyloxan-4-ol (PubChem CID 102291858) has the molecular formula C15H24O3 and a molecular weight of 252.35 g/mol. Its IUPAC name is (2R,4S,6S)-2-[(Z)-2-cyclohexyloxyethenyl]-6-ethenyloxan-4-ol.

Molecular Properties

Compound Name(2R,4S,6S)-2-[(Z)-2-cyclohexyloxyethenyl]-6-ethenyloxan-4-ol
PubChem CID102291858
Molecular FormulaC15H24O3
Molecular Weight252.35 g/mol
Exact Mass252.17
IUPAC Name(2R,4S,6S)-2-[(Z)-2-cyclohexyloxyethenyl]-6-ethenyloxan-4-ol
SMILESC=C[C@@H]1C[C@H](O)C[C@H](/C=C\OC2CCCCC2)O1
InChIInChI=1S/C15H24O3/c1-2-13-10-12(16)11-15(18-13)8-9-17-14-6-4-3-5-7-14/h2,8-9,12-16H,1,3-7,10-11H2/b9-8-/t12-,13+,15-/m0/s1
InChIKeyCZBPKOXIEHCNIS-RJQMRXGRSA-N
XLogP2.94
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.35
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze (2R,4S,6S)-2-[(Z)-2-cyclohexyloxyethenyl]-6-ethenyloxan-4-ol with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2R,4S,6S)-2-[(Z)-2-cyclohexyloxyethenyl]-6-ethenyloxan-4-ol?
The IUPAC name of (2R,4S,6S)-2-[(Z)-2-cyclohexyloxyethenyl]-6-ethenyloxan-4-ol (CID 102291858) is (2R,4S,6S)-2-[(Z)-2-cyclohexyloxyethenyl]-6-ethenyloxan-4-ol.
What is the SMILES notation for (2R,4S,6S)-2-[(Z)-2-cyclohexyloxyethenyl]-6-ethenyloxan-4-ol?
The canonical SMILES for (2R,4S,6S)-2-[(Z)-2-cyclohexyloxyethenyl]-6-ethenyloxan-4-ol is C=C[C@@H]1C[C@H](O)C[C@H](/C=C\OC2CCCCC2)O1.
What is the InChIKey of (2R,4S,6S)-2-[(Z)-2-cyclohexyloxyethenyl]-6-ethenyloxan-4-ol?
The InChIKey is CZBPKOXIEHCNIS-RJQMRXGRSA-N. The full InChI is InChI=1S/C15H24O3/c1-2-13-10-12(16)11-15(18-13)8-9-17-14-6-4-3-5-7-14/h2,8-9,12-16H,1,3-7,10-11H2/b9-8-/t12-,13+,15-/m0/s1.
What are the key properties of (2R,4S,6S)-2-[(Z)-2-cyclohexyloxyethenyl]-6-ethenyloxan-4-ol?
(2R,4S,6S)-2-[(Z)-2-cyclohexyloxyethenyl]-6-ethenyloxan-4-ol has a molecular weight of 252.35 g/mol, XLogP of 2.94, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,4S,6S)-2-[(Z)-2-cyclohexyloxyethenyl]-6-ethenyloxan-4-ol is sourced from PubChem (CID 102291858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).