4-cyclohexyl-4H-pyran

C11H16O — CID 10844759

IUPAC4-cyclohexyl-4H-pyran
SMILESC1=CC(C2CCCCC2)C=CO1
InChIInChI=1S/C11H16O/c1-2-4-10(5-3-1)11-6-8-12-9-7-11/h6-11H,1-5H2
InChIKeyHWMGJSHCLZKXJB-UHFFFAOYSA-N
MW164.25 g/mol
LogP3.24
Rot. Bonds1

About 4-cyclohexyl-4H-pyran

4-cyclohexyl-4H-pyran (PubChem CID 10844759) has the molecular formula C11H16O and a molecular weight of 164.25 g/mol. Its IUPAC name is 4-cyclohexyl-4H-pyran.

Molecular Properties

Compound Name4-cyclohexyl-4H-pyran
PubChem CID10844759
Molecular FormulaC11H16O
Molecular Weight164.25 g/mol
Exact Mass164.12
IUPAC Name4-cyclohexyl-4H-pyran
SMILESC1=CC(C2CCCCC2)C=CO1
InChIInChI=1S/C11H16O/c1-2-4-10(5-3-1)11-6-8-12-9-7-11/h6-11H,1-5H2
InChIKeyHWMGJSHCLZKXJB-UHFFFAOYSA-N
XLogP3.24
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 53.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-cyclohexyl-4H-pyran?
The IUPAC name of 4-cyclohexyl-4H-pyran (CID 10844759) is 4-cyclohexyl-4H-pyran.
What is the SMILES notation for 4-cyclohexyl-4H-pyran?
The canonical SMILES for 4-cyclohexyl-4H-pyran is C1=CC(C2CCCCC2)C=CO1.
What is the InChIKey of 4-cyclohexyl-4H-pyran?
The InChIKey is HWMGJSHCLZKXJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16O/c1-2-4-10(5-3-1)11-6-8-12-9-7-11/h6-11H,1-5H2.
What are the key properties of 4-cyclohexyl-4H-pyran?
4-cyclohexyl-4H-pyran has a molecular weight of 164.25 g/mol, XLogP of 3.24, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclohexyl-4H-pyran is sourced from PubChem (CID 10844759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).