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

C21H20FNO2 — CID 57328481

IUPAC4-ethenyl-2-(4-fluorophenyl)-N-[(4-methylphenyl)methyl]-2,5-dihydrofuran-3-carboxamide
SMILESC=CC1=C(C(=O)NCc2ccc(C)cc2)C(c2ccc(F)cc2)OC1
InChIInChI=1S/C21H20FNO2/c1-3-16-13-25-20(17-8-10-18(22)11-9-17)19(16)21(24)23-12-15-6-4-14(2)5-7-15/h3-11,20H,1,12-13H2,2H3,(H,23,24)
InChIKeyJXLCPKHFVVOOIL-UHFFFAOYSA-N
MW337.39 g/mol
LogP4.00
Rot. Bonds5

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

4-ethenyl-2-(4-fluorophenyl)-N-[(4-methylphenyl)methyl]-2,5-dihydrofuran-3-carboxamide (PubChem CID 57328481) has the molecular formula C21H20FNO2 and a molecular weight of 337.39 g/mol. Its IUPAC name is 4-ethenyl-2-(4-fluorophenyl)-N-[(4-methylphenyl)methyl]-2,5-dihydrofuran-3-carboxamide.

Molecular Properties

Compound Name4-ethenyl-2-(4-fluorophenyl)-N-[(4-methylphenyl)methyl]-2,5-dihydrofuran-3-carboxamide
PubChem CID57328481
Molecular FormulaC21H20FNO2
Molecular Weight337.39 g/mol
Exact Mass337.15
IUPAC Name4-ethenyl-2-(4-fluorophenyl)-N-[(4-methylphenyl)methyl]-2,5-dihydrofuran-3-carboxamide
SMILESC=CC1=C(C(=O)NCc2ccc(C)cc2)C(c2ccc(F)cc2)OC1
InChIInChI=1S/C21H20FNO2/c1-3-16-13-25-20(17-8-10-18(22)11-9-17)19(16)21(24)23-12-15-6-4-14(2)5-7-15/h3-11,20H,1,12-13H2,2H3,(H,23,24)
InChIKeyJXLCPKHFVVOOIL-UHFFFAOYSA-N
XLogP4.00
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.39
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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US8609678, 4-(2-(4-fluorophenyl)tetrahydrofuran-2-yl)-N-(7-(hydroxyamino)-7-oxoheptyl)benzamide [149]
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3-methyl-N-[(4-methylphenyl)methyl]-2-oxo-1-oxaspiro[4.5]dec-3-ene-4-carboxamide
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Frequently Asked Questions

What is the IUPAC name of 4-ethenyl-2-(4-fluorophenyl)-N-[(4-methylphenyl)methyl]-2,5-dihydrofuran-3-carboxamide?
The IUPAC name of 4-ethenyl-2-(4-fluorophenyl)-N-[(4-methylphenyl)methyl]-2,5-dihydrofuran-3-carboxamide (CID 57328481) is 4-ethenyl-2-(4-fluorophenyl)-N-[(4-methylphenyl)methyl]-2,5-dihydrofuran-3-carboxamide.
What is the SMILES notation for 4-ethenyl-2-(4-fluorophenyl)-N-[(4-methylphenyl)methyl]-2,5-dihydrofuran-3-carboxamide?
The canonical SMILES for 4-ethenyl-2-(4-fluorophenyl)-N-[(4-methylphenyl)methyl]-2,5-dihydrofuran-3-carboxamide is C=CC1=C(C(=O)NCc2ccc(C)cc2)C(c2ccc(F)cc2)OC1.
What is the InChIKey of 4-ethenyl-2-(4-fluorophenyl)-N-[(4-methylphenyl)methyl]-2,5-dihydrofuran-3-carboxamide?
The InChIKey is JXLCPKHFVVOOIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20FNO2/c1-3-16-13-25-20(17-8-10-18(22)11-9-17)19(16)21(24)23-12-15-6-4-14(2)5-7-15/h3-11,20H,1,12-13H2,2H3,(H,23,24).
What are the key properties of 4-ethenyl-2-(4-fluorophenyl)-N-[(4-methylphenyl)methyl]-2,5-dihydrofuran-3-carboxamide?
4-ethenyl-2-(4-fluorophenyl)-N-[(4-methylphenyl)methyl]-2,5-dihydrofuran-3-carboxamide has a molecular weight of 337.39 g/mol, XLogP of 4.00, 5 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-[(4-methylphenyl)methyl]-2,5-dihydrofuran-3-carboxamide is sourced from PubChem (CID 57328481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).