5-cyclohexyl-2-cyclopropylfuran-3-carbaldehyde

C14H18O2 — CID 165451234

IUPAC5-cyclohexyl-2-cyclopropylfuran-3-carbaldehyde
SMILESO=Cc1cc(C2CCCCC2)oc1C1CC1
InChIInChI=1S/C14H18O2/c15-9-12-8-13(10-4-2-1-3-5-10)16-14(12)11-6-7-11/h8-11H,1-7H2
InChIKeyFHASDWLJQATKAV-UHFFFAOYSA-N
MW218.30 g/mol
LogP4.02
Rot. Bonds3

About 5-cyclohexyl-2-cyclopropylfuran-3-carbaldehyde

5-cyclohexyl-2-cyclopropylfuran-3-carbaldehyde (PubChem CID 165451234) has the molecular formula C14H18O2 and a molecular weight of 218.30 g/mol. Its IUPAC name is 5-cyclohexyl-2-cyclopropylfuran-3-carbaldehyde.

Molecular Properties

Compound Name5-cyclohexyl-2-cyclopropylfuran-3-carbaldehyde
PubChem CID165451234
Molecular FormulaC14H18O2
Molecular Weight218.30 g/mol
Exact Mass218.13
IUPAC Name5-cyclohexyl-2-cyclopropylfuran-3-carbaldehyde
SMILESO=Cc1cc(C2CCCCC2)oc1C1CC1
InChIInChI=1S/C14H18O2/c15-9-12-8-13(10-4-2-1-3-5-10)16-14(12)11-6-7-11/h8-11H,1-7H2
InChIKeyFHASDWLJQATKAV-UHFFFAOYSA-N
XLogP4.02
TPSA30.21 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 54.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-cyclohexyl-2-cyclopropylfuran-3-carbaldehyde?
The IUPAC name of 5-cyclohexyl-2-cyclopropylfuran-3-carbaldehyde (CID 165451234) is 5-cyclohexyl-2-cyclopropylfuran-3-carbaldehyde.
What is the SMILES notation for 5-cyclohexyl-2-cyclopropylfuran-3-carbaldehyde?
The canonical SMILES for 5-cyclohexyl-2-cyclopropylfuran-3-carbaldehyde is O=Cc1cc(C2CCCCC2)oc1C1CC1.
What is the InChIKey of 5-cyclohexyl-2-cyclopropylfuran-3-carbaldehyde?
The InChIKey is FHASDWLJQATKAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18O2/c15-9-12-8-13(10-4-2-1-3-5-10)16-14(12)11-6-7-11/h8-11H,1-7H2.
What are the key properties of 5-cyclohexyl-2-cyclopropylfuran-3-carbaldehyde?
5-cyclohexyl-2-cyclopropylfuran-3-carbaldehyde has a molecular weight of 218.30 g/mol, XLogP of 4.02, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclohexyl-2-cyclopropylfuran-3-carbaldehyde is sourced from PubChem (CID 165451234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).