2-cyclohexyl-3,3a-dihydro-2H-furo[3,2-b]pyran

C13H18O2 — CID 175844194

IUPAC2-cyclohexyl-3,3a-dihydro-2H-furo[3,2-b]pyran
SMILESC1=COC2CC(C3CCCCC3)OC2=C1
InChIInChI=1S/C13H18O2/c1-2-5-10(6-3-1)12-9-13-11(15-12)7-4-8-14-13/h4,7-8,10,12-13H,1-3,5-6,9H2
InChIKeyJAHRXIAAOBKGBB-UHFFFAOYSA-N
MW206.29 g/mol
LogP3.15
Rot. Bonds1

About 2-cyclohexyl-3,3a-dihydro-2H-furo[3,2-b]pyran

2-cyclohexyl-3,3a-dihydro-2H-furo[3,2-b]pyran (PubChem CID 175844194) has the molecular formula C13H18O2 and a molecular weight of 206.29 g/mol. Its IUPAC name is 2-cyclohexyl-3,3a-dihydro-2H-furo[3,2-b]pyran.

Molecular Properties

Compound Name2-cyclohexyl-3,3a-dihydro-2H-furo[3,2-b]pyran
PubChem CID175844194
Molecular FormulaC13H18O2
Molecular Weight206.29 g/mol
Exact Mass206.13
IUPAC Name2-cyclohexyl-3,3a-dihydro-2H-furo[3,2-b]pyran
SMILESC1=COC2CC(C3CCCCC3)OC2=C1
InChIInChI=1S/C13H18O2/c1-2-5-10(6-3-1)12-9-13-11(15-12)7-4-8-14-13/h4,7-8,10,12-13H,1-3,5-6,9H2
InChIKeyJAHRXIAAOBKGBB-UHFFFAOYSA-N
XLogP3.15
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-3,3a-dihydro-2H-furo[3,2-b]pyran?
The IUPAC name of 2-cyclohexyl-3,3a-dihydro-2H-furo[3,2-b]pyran (CID 175844194) is 2-cyclohexyl-3,3a-dihydro-2H-furo[3,2-b]pyran.
What is the SMILES notation for 2-cyclohexyl-3,3a-dihydro-2H-furo[3,2-b]pyran?
The canonical SMILES for 2-cyclohexyl-3,3a-dihydro-2H-furo[3,2-b]pyran is C1=COC2CC(C3CCCCC3)OC2=C1.
What is the InChIKey of 2-cyclohexyl-3,3a-dihydro-2H-furo[3,2-b]pyran?
The InChIKey is JAHRXIAAOBKGBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18O2/c1-2-5-10(6-3-1)12-9-13-11(15-12)7-4-8-14-13/h4,7-8,10,12-13H,1-3,5-6,9H2.
What are the key properties of 2-cyclohexyl-3,3a-dihydro-2H-furo[3,2-b]pyran?
2-cyclohexyl-3,3a-dihydro-2H-furo[3,2-b]pyran has a molecular weight of 206.29 g/mol, XLogP of 3.15, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-3,3a-dihydro-2H-furo[3,2-b]pyran is sourced from PubChem (CID 175844194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).