(2S,5R)-5-ethyl-2,3,4,5-tetramethyl-2H-furan

C10H18O — CID 89295959

IUPAC(2S,5R)-5-ethyl-2,3,4,5-tetramethyl-2H-furan
SMILESCC[C@@]1(C)O[C@@H](C)C(C)=C1C
InChIInChI=1S/C10H18O/c1-6-10(5)8(3)7(2)9(4)11-10/h9H,6H2,1-5H3/t9-,10+/m0/s1
InChIKeyDWOUKRBNFDACAS-VHSXEESVSA-N
MW154.25 g/mol
LogP2.91
Rot. Bonds1

About (2S,5R)-5-ethyl-2,3,4,5-tetramethyl-2H-furan

(2S,5R)-5-ethyl-2,3,4,5-tetramethyl-2H-furan (PubChem CID 89295959) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is (2S,5R)-5-ethyl-2,3,4,5-tetramethyl-2H-furan.

Molecular Properties

Compound Name(2S,5R)-5-ethyl-2,3,4,5-tetramethyl-2H-furan
PubChem CID89295959
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Name(2S,5R)-5-ethyl-2,3,4,5-tetramethyl-2H-furan
SMILESCC[C@@]1(C)O[C@@H](C)C(C)=C1C
InChIInChI=1S/C10H18O/c1-6-10(5)8(3)7(2)9(4)11-10/h9H,6H2,1-5H3/t9-,10+/m0/s1
InChIKeyDWOUKRBNFDACAS-VHSXEESVSA-N
XLogP2.91
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.25
LogP ≤ 52.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 (2S,5R)-5-ethyl-2,3,4,5-tetramethyl-2H-furan?
The IUPAC name of (2S,5R)-5-ethyl-2,3,4,5-tetramethyl-2H-furan (CID 89295959) is (2S,5R)-5-ethyl-2,3,4,5-tetramethyl-2H-furan.
What is the SMILES notation for (2S,5R)-5-ethyl-2,3,4,5-tetramethyl-2H-furan?
The canonical SMILES for (2S,5R)-5-ethyl-2,3,4,5-tetramethyl-2H-furan is CC[C@@]1(C)O[C@@H](C)C(C)=C1C.
What is the InChIKey of (2S,5R)-5-ethyl-2,3,4,5-tetramethyl-2H-furan?
The InChIKey is DWOUKRBNFDACAS-VHSXEESVSA-N. The full InChI is InChI=1S/C10H18O/c1-6-10(5)8(3)7(2)9(4)11-10/h9H,6H2,1-5H3/t9-,10+/m0/s1.
What are the key properties of (2S,5R)-5-ethyl-2,3,4,5-tetramethyl-2H-furan?
(2S,5R)-5-ethyl-2,3,4,5-tetramethyl-2H-furan has a molecular weight of 154.25 g/mol, XLogP of 2.91, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,5R)-5-ethyl-2,3,4,5-tetramethyl-2H-furan is sourced from PubChem (CID 89295959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).