(4R,6R)-4-(cyclohexylmethyl)-6-ethenyl-2,2-dimethyl-1,3-dioxane

C15H26O2 — CID 134975609

IUPAC(4R,6R)-4-(cyclohexylmethyl)-6-ethenyl-2,2-dimethyl-1,3-dioxane
SMILESC=C[C@H]1C[C@@H](CC2CCCCC2)OC(C)(C)O1
InChIInChI=1S/C15H26O2/c1-4-13-11-14(17-15(2,3)16-13)10-12-8-6-5-7-9-12/h4,12-14H,1,5-11H2,2-3H3/t13-,14+/m0/s1
InChIKeyHLZDTEPOHHDPNR-UONOGXRCSA-N
MW238.37 g/mol
LogP4.05
Rot. Bonds3

About (4R,6R)-4-(cyclohexylmethyl)-6-ethenyl-2,2-dimethyl-1,3-dioxane

(4R,6R)-4-(cyclohexylmethyl)-6-ethenyl-2,2-dimethyl-1,3-dioxane (PubChem CID 134975609) has the molecular formula C15H26O2 and a molecular weight of 238.37 g/mol. Its IUPAC name is (4R,6R)-4-(cyclohexylmethyl)-6-ethenyl-2,2-dimethyl-1,3-dioxane.

Molecular Properties

Compound Name(4R,6R)-4-(cyclohexylmethyl)-6-ethenyl-2,2-dimethyl-1,3-dioxane
PubChem CID134975609
Molecular FormulaC15H26O2
Molecular Weight238.37 g/mol
Exact Mass238.19
IUPAC Name(4R,6R)-4-(cyclohexylmethyl)-6-ethenyl-2,2-dimethyl-1,3-dioxane
SMILESC=C[C@H]1C[C@@H](CC2CCCCC2)OC(C)(C)O1
InChIInChI=1S/C15H26O2/c1-4-13-11-14(17-15(2,3)16-13)10-12-8-6-5-7-9-12/h4,12-14H,1,5-11H2,2-3H3/t13-,14+/m0/s1
InChIKeyHLZDTEPOHHDPNR-UONOGXRCSA-N
XLogP4.05
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 54.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze (4R,6R)-4-(cyclohexylmethyl)-6-ethenyl-2,2-dimethyl-1,3-dioxane 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 (4R,6R)-4-(cyclohexylmethyl)-6-ethenyl-2,2-dimethyl-1,3-dioxane?
The IUPAC name of (4R,6R)-4-(cyclohexylmethyl)-6-ethenyl-2,2-dimethyl-1,3-dioxane (CID 134975609) is (4R,6R)-4-(cyclohexylmethyl)-6-ethenyl-2,2-dimethyl-1,3-dioxane.
What is the SMILES notation for (4R,6R)-4-(cyclohexylmethyl)-6-ethenyl-2,2-dimethyl-1,3-dioxane?
The canonical SMILES for (4R,6R)-4-(cyclohexylmethyl)-6-ethenyl-2,2-dimethyl-1,3-dioxane is C=C[C@H]1C[C@@H](CC2CCCCC2)OC(C)(C)O1.
What is the InChIKey of (4R,6R)-4-(cyclohexylmethyl)-6-ethenyl-2,2-dimethyl-1,3-dioxane?
The InChIKey is HLZDTEPOHHDPNR-UONOGXRCSA-N. The full InChI is InChI=1S/C15H26O2/c1-4-13-11-14(17-15(2,3)16-13)10-12-8-6-5-7-9-12/h4,12-14H,1,5-11H2,2-3H3/t13-,14+/m0/s1.
What are the key properties of (4R,6R)-4-(cyclohexylmethyl)-6-ethenyl-2,2-dimethyl-1,3-dioxane?
(4R,6R)-4-(cyclohexylmethyl)-6-ethenyl-2,2-dimethyl-1,3-dioxane has a molecular weight of 238.37 g/mol, XLogP of 4.05, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R,6R)-4-(cyclohexylmethyl)-6-ethenyl-2,2-dimethyl-1,3-dioxane is sourced from PubChem (CID 134975609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).