2-ethyl-5-[(E)-3-phenylprop-2-enyl]furan

C15H16O — CID 45095037

IUPAC2-ethyl-5-[(E)-3-phenylprop-2-enyl]furan
SMILESCCc1ccc(C/C=C/c2ccccc2)o1
InChIInChI=1S/C15H16O/c1-2-14-11-12-15(16-14)10-6-9-13-7-4-3-5-8-13/h3-9,11-12H,2,10H2,1H3/b9-6+
InChIKeyJKWMWRVIAVWRKV-RMKNXTFCSA-N
MW212.29 g/mol
LogP4.10
Rot. Bonds4

About 2-ethyl-5-[(E)-3-phenylprop-2-enyl]furan

2-ethyl-5-[(E)-3-phenylprop-2-enyl]furan (PubChem CID 45095037) has the molecular formula C15H16O and a molecular weight of 212.29 g/mol. Its IUPAC name is 2-ethyl-5-[(E)-3-phenylprop-2-enyl]furan.

Molecular Properties

Compound Name2-ethyl-5-[(E)-3-phenylprop-2-enyl]furan
PubChem CID45095037
Molecular FormulaC15H16O
Molecular Weight212.29 g/mol
Exact Mass212.12
IUPAC Name2-ethyl-5-[(E)-3-phenylprop-2-enyl]furan
SMILESCCc1ccc(C/C=C/c2ccccc2)o1
InChIInChI=1S/C15H16O/c1-2-14-11-12-15(16-14)10-6-9-13-7-4-3-5-8-13/h3-9,11-12H,2,10H2,1H3/b9-6+
InChIKeyJKWMWRVIAVWRKV-RMKNXTFCSA-N
XLogP4.10
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 54.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

benzene;but-1-enylbenzene
CID 157481332
ethane;[(E)-3-phenylprop-1-enyl]benzene
CID 143041114
[(1E)-5-phenylpenta-1,4-dienyl]benzene
CID 91021368
3-phenylprop-1-enylbenzene;tetrahydrofluoride
CID 174822249
4-iodo-5,5-dimethyl-3-[(E)-3-phenylprop-2-enyl]furan-2-one
CID 45276563
2-methyl-5-(3-phenylprop-2-enyl)-1,3,4-oxadiazole
CID 68949565
ethane;[(E)-pent-1-enyl]benzene
CID 143265687
[(E)-octadec-1-enyl]benzene
CID 22722345
4-ethyl-2-[(E)-3-phenylprop-2-enyl]phenol
CID 12564792
[(1E,4E)-hexa-1,4-dienyl]benzene
CID 13068859
hex-1-enylbenzene;prop-1-ene
CID 157442084
[(E)-3-[(E)-but-1-enoxy]prop-1-enyl]benzene
CID 10726289

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-5-[(E)-3-phenylprop-2-enyl]furan?
The IUPAC name of 2-ethyl-5-[(E)-3-phenylprop-2-enyl]furan (CID 45095037) is 2-ethyl-5-[(E)-3-phenylprop-2-enyl]furan.
What is the SMILES notation for 2-ethyl-5-[(E)-3-phenylprop-2-enyl]furan?
The canonical SMILES for 2-ethyl-5-[(E)-3-phenylprop-2-enyl]furan is CCc1ccc(C/C=C/c2ccccc2)o1.
What is the InChIKey of 2-ethyl-5-[(E)-3-phenylprop-2-enyl]furan?
The InChIKey is JKWMWRVIAVWRKV-RMKNXTFCSA-N. The full InChI is InChI=1S/C15H16O/c1-2-14-11-12-15(16-14)10-6-9-13-7-4-3-5-8-13/h3-9,11-12H,2,10H2,1H3/b9-6+.
What are the key properties of 2-ethyl-5-[(E)-3-phenylprop-2-enyl]furan?
2-ethyl-5-[(E)-3-phenylprop-2-enyl]furan has a molecular weight of 212.29 g/mol, XLogP of 4.10, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-5-[(E)-3-phenylprop-2-enyl]furan is sourced from PubChem (CID 45095037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).