2,3,4-triethyl-5-methylfuran

C11H18O — CID 89376358

IUPAC2,3,4-triethyl-5-methylfuran
SMILESCCc1oc(C)c(CC)c1CC
InChIInChI=1S/C11H18O/c1-5-9-8(4)12-11(7-3)10(9)6-2/h5-7H2,1-4H3
InChIKeyLWULCYVNSDPCGQ-UHFFFAOYSA-N
MW166.26 g/mol
LogP3.28
Rot. Bonds3

About 2,3,4-triethyl-5-methylfuran

2,3,4-triethyl-5-methylfuran (PubChem CID 89376358) has the molecular formula C11H18O and a molecular weight of 166.26 g/mol. Its IUPAC name is 2,3,4-triethyl-5-methylfuran.

Molecular Properties

Compound Name2,3,4-triethyl-5-methylfuran
PubChem CID89376358
Molecular FormulaC11H18O
Molecular Weight166.26 g/mol
Exact Mass166.14
IUPAC Name2,3,4-triethyl-5-methylfuran
SMILESCCc1oc(C)c(CC)c1CC
InChIInChI=1S/C11H18O/c1-5-9-8(4)12-11(7-3)10(9)6-2/h5-7H2,1-4H3
InChIKeyLWULCYVNSDPCGQ-UHFFFAOYSA-N
XLogP3.28
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.26
LogP ≤ 53.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,3,4-triethyl-5-methylfuran?
The IUPAC name of 2,3,4-triethyl-5-methylfuran (CID 89376358) is 2,3,4-triethyl-5-methylfuran.
What is the SMILES notation for 2,3,4-triethyl-5-methylfuran?
The canonical SMILES for 2,3,4-triethyl-5-methylfuran is CCc1oc(C)c(CC)c1CC.
What is the InChIKey of 2,3,4-triethyl-5-methylfuran?
The InChIKey is LWULCYVNSDPCGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18O/c1-5-9-8(4)12-11(7-3)10(9)6-2/h5-7H2,1-4H3.
What are the key properties of 2,3,4-triethyl-5-methylfuran?
2,3,4-triethyl-5-methylfuran has a molecular weight of 166.26 g/mol, XLogP of 3.28, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,4-triethyl-5-methylfuran is sourced from PubChem (CID 89376358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).