2-[(E)-pent-1-enyl]furan

C9H12O — CID 5369956

IUPAC2-[(E)-pent-1-enyl]furan
SMILESCCC/C=C/c1ccco1
InChIInChI=1S/C9H12O/c1-2-3-4-6-9-7-5-8-10-9/h4-8H,2-3H2,1H3/b6-4+
InChIKeyLKSYSJTUBQSZBS-GQCTYLIASA-N
MW136.19 g/mol
LogP3.09
Rot. Bonds3

About 2-[(E)-pent-1-enyl]furan

2-[(E)-pent-1-enyl]furan (PubChem CID 5369956) has the molecular formula C9H12O and a molecular weight of 136.19 g/mol. Its IUPAC name is 2-[(E)-pent-1-enyl]furan.

Molecular Properties

Compound Name2-[(E)-pent-1-enyl]furan
PubChem CID5369956
Molecular FormulaC9H12O
Molecular Weight136.19 g/mol
Exact Mass136.09
IUPAC Name2-[(E)-pent-1-enyl]furan
SMILESCCC/C=C/c1ccco1
InChIInChI=1S/C9H12O/c1-2-3-4-6-9-7-5-8-10-9/h4-8H,2-3H2,1H3/b6-4+
InChIKeyLKSYSJTUBQSZBS-GQCTYLIASA-N
XLogP3.09
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.19
LogP ≤ 53.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-[(E)-pent-1-enyl]furan?
The IUPAC name of 2-[(E)-pent-1-enyl]furan (CID 5369956) is 2-[(E)-pent-1-enyl]furan.
What is the SMILES notation for 2-[(E)-pent-1-enyl]furan?
The canonical SMILES for 2-[(E)-pent-1-enyl]furan is CCC/C=C/c1ccco1.
What is the InChIKey of 2-[(E)-pent-1-enyl]furan?
The InChIKey is LKSYSJTUBQSZBS-GQCTYLIASA-N. The full InChI is InChI=1S/C9H12O/c1-2-3-4-6-9-7-5-8-10-9/h4-8H,2-3H2,1H3/b6-4+.
What are the key properties of 2-[(E)-pent-1-enyl]furan?
2-[(E)-pent-1-enyl]furan has a molecular weight of 136.19 g/mol, XLogP of 3.09, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(E)-pent-1-enyl]furan is sourced from PubChem (CID 5369956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).