(5E)-5-(2-methoxypropylidene)-4-methyl-2H-furan

C9H14O2 — CID 134890261

IUPAC(5E)-5-(2-methoxypropylidene)-4-methyl-2H-furan
SMILESCOC(C)/C=C1/OCC=C1C
InChIInChI=1S/C9H14O2/c1-7-4-5-11-9(7)6-8(2)10-3/h4,6,8H,5H2,1-3H3/b9-6+
InChIKeyHCCOPICFIWTXKB-RMKNXTFCSA-N
MW154.21 g/mol
LogP1.88
Rot. Bonds2

About (5E)-5-(2-methoxypropylidene)-4-methyl-2H-furan

(5E)-5-(2-methoxypropylidene)-4-methyl-2H-furan (PubChem CID 134890261) has the molecular formula C9H14O2 and a molecular weight of 154.21 g/mol. Its IUPAC name is (5E)-5-(2-methoxypropylidene)-4-methyl-2H-furan.

Molecular Properties

Compound Name(5E)-5-(2-methoxypropylidene)-4-methyl-2H-furan
PubChem CID134890261
Molecular FormulaC9H14O2
Molecular Weight154.21 g/mol
Exact Mass154.10
IUPAC Name(5E)-5-(2-methoxypropylidene)-4-methyl-2H-furan
SMILESCOC(C)/C=C1/OCC=C1C
InChIInChI=1S/C9H14O2/c1-7-4-5-11-9(7)6-8(2)10-3/h4,6,8H,5H2,1-3H3/b9-6+
InChIKeyHCCOPICFIWTXKB-RMKNXTFCSA-N
XLogP1.88
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.21
LogP ≤ 51.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (5E)-5-(2-methoxypropylidene)-4-methyl-2H-furan?
The IUPAC name of (5E)-5-(2-methoxypropylidene)-4-methyl-2H-furan (CID 134890261) is (5E)-5-(2-methoxypropylidene)-4-methyl-2H-furan.
What is the SMILES notation for (5E)-5-(2-methoxypropylidene)-4-methyl-2H-furan?
The canonical SMILES for (5E)-5-(2-methoxypropylidene)-4-methyl-2H-furan is COC(C)/C=C1/OCC=C1C.
What is the InChIKey of (5E)-5-(2-methoxypropylidene)-4-methyl-2H-furan?
The InChIKey is HCCOPICFIWTXKB-RMKNXTFCSA-N. The full InChI is InChI=1S/C9H14O2/c1-7-4-5-11-9(7)6-8(2)10-3/h4,6,8H,5H2,1-3H3/b9-6+.
What are the key properties of (5E)-5-(2-methoxypropylidene)-4-methyl-2H-furan?
(5E)-5-(2-methoxypropylidene)-4-methyl-2H-furan has a molecular weight of 154.21 g/mol, XLogP of 1.88, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5E)-5-(2-methoxypropylidene)-4-methyl-2H-furan is sourced from PubChem (CID 134890261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).