3-(5-ethylfuran-2-yl)-N-(4-fluorophenyl)propanamide

C15H16FNO2 — CID 939193

IUPAC3-(5-ethylfuran-2-yl)-N-(4-fluorophenyl)propanamide
SMILESCCc1ccc(CCC(=O)Nc2ccc(F)cc2)o1
InChIInChI=1S/C15H16FNO2/c1-2-13-7-8-14(19-13)9-10-15(18)17-12-5-3-11(16)4-6-12/h3-8H,2,9-10H2,1H3,(H,17,18)
InChIKeyFKKYQUKERSIEFW-UHFFFAOYSA-N
MW261.30 g/mol
LogP3.55
Rot. Bonds5

About 3-(5-ethylfuran-2-yl)-N-(4-fluorophenyl)propanamide

3-(5-ethylfuran-2-yl)-N-(4-fluorophenyl)propanamide (PubChem CID 939193) has the molecular formula C15H16FNO2 and a molecular weight of 261.30 g/mol. Its IUPAC name is 3-(5-ethylfuran-2-yl)-N-(4-fluorophenyl)propanamide.

Molecular Properties

Compound Name3-(5-ethylfuran-2-yl)-N-(4-fluorophenyl)propanamide
PubChem CID939193
Molecular FormulaC15H16FNO2
Molecular Weight261.30 g/mol
Exact Mass261.12
IUPAC Name3-(5-ethylfuran-2-yl)-N-(4-fluorophenyl)propanamide
SMILESCCc1ccc(CCC(=O)Nc2ccc(F)cc2)o1
InChIInChI=1S/C15H16FNO2/c1-2-13-7-8-14(19-13)9-10-15(18)17-12-5-3-11(16)4-6-12/h3-8H,2,9-10H2,1H3,(H,17,18)
InChIKeyFKKYQUKERSIEFW-UHFFFAOYSA-N
XLogP3.55
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.30
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(5-ethylfuran-2-yl)-N-(4-fluorophenyl)propanamide?
The IUPAC name of 3-(5-ethylfuran-2-yl)-N-(4-fluorophenyl)propanamide (CID 939193) is 3-(5-ethylfuran-2-yl)-N-(4-fluorophenyl)propanamide.
What is the SMILES notation for 3-(5-ethylfuran-2-yl)-N-(4-fluorophenyl)propanamide?
The canonical SMILES for 3-(5-ethylfuran-2-yl)-N-(4-fluorophenyl)propanamide is CCc1ccc(CCC(=O)Nc2ccc(F)cc2)o1.
What is the InChIKey of 3-(5-ethylfuran-2-yl)-N-(4-fluorophenyl)propanamide?
The InChIKey is FKKYQUKERSIEFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FNO2/c1-2-13-7-8-14(19-13)9-10-15(18)17-12-5-3-11(16)4-6-12/h3-8H,2,9-10H2,1H3,(H,17,18).
What are the key properties of 3-(5-ethylfuran-2-yl)-N-(4-fluorophenyl)propanamide?
3-(5-ethylfuran-2-yl)-N-(4-fluorophenyl)propanamide has a molecular weight of 261.30 g/mol, XLogP of 3.55, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-ethylfuran-2-yl)-N-(4-fluorophenyl)propanamide is sourced from PubChem (CID 939193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).