4-butyl-5-cyclohexyl-2,5-dihydrofuran-2-ol

C14H24O2 — CID 134890243

IUPAC4-butyl-5-cyclohexyl-2,5-dihydrofuran-2-ol
SMILESCCCCC1=CC(O)OC1C1CCCCC1
InChIInChI=1S/C14H24O2/c1-2-3-7-12-10-13(15)16-14(12)11-8-5-4-6-9-11/h10-11,13-15H,2-9H2,1H3
InChIKeyPOGVBRXCVJPYAT-UHFFFAOYSA-N
MW224.34 g/mol
LogP3.40
Rot. Bonds4

About 4-butyl-5-cyclohexyl-2,5-dihydrofuran-2-ol

4-butyl-5-cyclohexyl-2,5-dihydrofuran-2-ol (PubChem CID 134890243) has the molecular formula C14H24O2 and a molecular weight of 224.34 g/mol. Its IUPAC name is 4-butyl-5-cyclohexyl-2,5-dihydrofuran-2-ol.

Molecular Properties

Compound Name4-butyl-5-cyclohexyl-2,5-dihydrofuran-2-ol
PubChem CID134890243
Molecular FormulaC14H24O2
Molecular Weight224.34 g/mol
Exact Mass224.18
IUPAC Name4-butyl-5-cyclohexyl-2,5-dihydrofuran-2-ol
SMILESCCCCC1=CC(O)OC1C1CCCCC1
InChIInChI=1S/C14H24O2/c1-2-3-7-12-10-13(15)16-14(12)11-8-5-4-6-9-11/h10-11,13-15H,2-9H2,1H3
InChIKeyPOGVBRXCVJPYAT-UHFFFAOYSA-N
XLogP3.40
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.34
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-butyl-5-cyclohexyl-2,5-dihydrofuran-2-ol?
The IUPAC name of 4-butyl-5-cyclohexyl-2,5-dihydrofuran-2-ol (CID 134890243) is 4-butyl-5-cyclohexyl-2,5-dihydrofuran-2-ol.
What is the SMILES notation for 4-butyl-5-cyclohexyl-2,5-dihydrofuran-2-ol?
The canonical SMILES for 4-butyl-5-cyclohexyl-2,5-dihydrofuran-2-ol is CCCCC1=CC(O)OC1C1CCCCC1.
What is the InChIKey of 4-butyl-5-cyclohexyl-2,5-dihydrofuran-2-ol?
The InChIKey is POGVBRXCVJPYAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24O2/c1-2-3-7-12-10-13(15)16-14(12)11-8-5-4-6-9-11/h10-11,13-15H,2-9H2,1H3.
What are the key properties of 4-butyl-5-cyclohexyl-2,5-dihydrofuran-2-ol?
4-butyl-5-cyclohexyl-2,5-dihydrofuran-2-ol has a molecular weight of 224.34 g/mol, XLogP of 3.40, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-butyl-5-cyclohexyl-2,5-dihydrofuran-2-ol is sourced from PubChem (CID 134890243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).