4-ethenyl-2-(4-fluorophenyl)-N-[2-(2-fluorophenyl)ethyl]-2,5-dihydrofuran-3-carboxamide

C21H19F2NO2 — CID 57328486

IUPAC4-ethenyl-2-(4-fluorophenyl)-N-[2-(2-fluorophenyl)ethyl]-2,5-dihydrofuran-3-carboxamide
SMILESC=CC1=C(C(=O)NCCc2ccccc2F)C(c2ccc(F)cc2)OC1
InChIInChI=1S/C21H19F2NO2/c1-2-14-13-26-20(16-7-9-17(22)10-8-16)19(14)21(25)24-12-11-15-5-3-4-6-18(15)23/h2-10,20H,1,11-13H2,(H,24,25)
InChIKeyXRBCJNYXHMRRDP-UHFFFAOYSA-N
MW355.38 g/mol
LogP3.88
Rot. Bonds6

About 4-ethenyl-2-(4-fluorophenyl)-N-[2-(2-fluorophenyl)ethyl]-2,5-dihydrofuran-3-carboxamide

4-ethenyl-2-(4-fluorophenyl)-N-[2-(2-fluorophenyl)ethyl]-2,5-dihydrofuran-3-carboxamide (PubChem CID 57328486) has the molecular formula C21H19F2NO2 and a molecular weight of 355.38 g/mol. Its IUPAC name is 4-ethenyl-2-(4-fluorophenyl)-N-[2-(2-fluorophenyl)ethyl]-2,5-dihydrofuran-3-carboxamide.

Molecular Properties

Compound Name4-ethenyl-2-(4-fluorophenyl)-N-[2-(2-fluorophenyl)ethyl]-2,5-dihydrofuran-3-carboxamide
PubChem CID57328486
Molecular FormulaC21H19F2NO2
Molecular Weight355.38 g/mol
Exact Mass355.14
IUPAC Name4-ethenyl-2-(4-fluorophenyl)-N-[2-(2-fluorophenyl)ethyl]-2,5-dihydrofuran-3-carboxamide
SMILESC=CC1=C(C(=O)NCCc2ccccc2F)C(c2ccc(F)cc2)OC1
InChIInChI=1S/C21H19F2NO2/c1-2-14-13-26-20(16-7-9-17(22)10-8-16)19(14)21(25)24-12-11-15-5-3-4-6-18(15)23/h2-10,20H,1,11-13H2,(H,24,25)
InChIKeyXRBCJNYXHMRRDP-UHFFFAOYSA-N
XLogP3.88
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.38
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-ethenyl-2-(4-fluorophenyl)-N-[2-(2-fluorophenyl)ethyl]-2,5-dihydrofuran-3-carboxamide?
The IUPAC name of 4-ethenyl-2-(4-fluorophenyl)-N-[2-(2-fluorophenyl)ethyl]-2,5-dihydrofuran-3-carboxamide (CID 57328486) is 4-ethenyl-2-(4-fluorophenyl)-N-[2-(2-fluorophenyl)ethyl]-2,5-dihydrofuran-3-carboxamide.
What is the SMILES notation for 4-ethenyl-2-(4-fluorophenyl)-N-[2-(2-fluorophenyl)ethyl]-2,5-dihydrofuran-3-carboxamide?
The canonical SMILES for 4-ethenyl-2-(4-fluorophenyl)-N-[2-(2-fluorophenyl)ethyl]-2,5-dihydrofuran-3-carboxamide is C=CC1=C(C(=O)NCCc2ccccc2F)C(c2ccc(F)cc2)OC1.
What is the InChIKey of 4-ethenyl-2-(4-fluorophenyl)-N-[2-(2-fluorophenyl)ethyl]-2,5-dihydrofuran-3-carboxamide?
The InChIKey is XRBCJNYXHMRRDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19F2NO2/c1-2-14-13-26-20(16-7-9-17(22)10-8-16)19(14)21(25)24-12-11-15-5-3-4-6-18(15)23/h2-10,20H,1,11-13H2,(H,24,25).
What are the key properties of 4-ethenyl-2-(4-fluorophenyl)-N-[2-(2-fluorophenyl)ethyl]-2,5-dihydrofuran-3-carboxamide?
4-ethenyl-2-(4-fluorophenyl)-N-[2-(2-fluorophenyl)ethyl]-2,5-dihydrofuran-3-carboxamide has a molecular weight of 355.38 g/mol, XLogP of 3.88, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethenyl-2-(4-fluorophenyl)-N-[2-(2-fluorophenyl)ethyl]-2,5-dihydrofuran-3-carboxamide is sourced from PubChem (CID 57328486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).