3-[5-(2-fluorophenyl)furan-2-yl]-N-(2-phenoxyethyl)propanamide

C21H20FNO3 — CID 32934045

IUPAC3-[5-(2-fluorophenyl)furan-2-yl]-N-(2-phenoxyethyl)propanamide
SMILESO=C(CCc1ccc(-c2ccccc2F)o1)NCCOc1ccccc1
InChIInChI=1S/C21H20FNO3/c22-19-9-5-4-8-18(19)20-12-10-17(26-20)11-13-21(24)23-14-15-25-16-6-2-1-3-7-16/h1-10,12H,11,13-15H2,(H,23,24)
InChIKeyRLTFNZSHCNUYET-UHFFFAOYSA-N
MW353.39 g/mol
LogP4.21
Rot. Bonds8

About 3-[5-(2-fluorophenyl)furan-2-yl]-N-(2-phenoxyethyl)propanamide

3-[5-(2-fluorophenyl)furan-2-yl]-N-(2-phenoxyethyl)propanamide (PubChem CID 32934045) has the molecular formula C21H20FNO3 and a molecular weight of 353.39 g/mol. Its IUPAC name is 3-[5-(2-fluorophenyl)furan-2-yl]-N-(2-phenoxyethyl)propanamide.

Molecular Properties

Compound Name3-[5-(2-fluorophenyl)furan-2-yl]-N-(2-phenoxyethyl)propanamide
PubChem CID32934045
Molecular FormulaC21H20FNO3
Molecular Weight353.39 g/mol
Exact Mass353.14
IUPAC Name3-[5-(2-fluorophenyl)furan-2-yl]-N-(2-phenoxyethyl)propanamide
SMILESO=C(CCc1ccc(-c2ccccc2F)o1)NCCOc1ccccc1
InChIInChI=1S/C21H20FNO3/c22-19-9-5-4-8-18(19)20-12-10-17(26-20)11-13-21(24)23-14-15-25-16-6-2-1-3-7-16/h1-10,12H,11,13-15H2,(H,23,24)
InChIKeyRLTFNZSHCNUYET-UHFFFAOYSA-N
XLogP4.21
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.39
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(3-phenoxypropyl)-3-(5-phenylfuran-2-yl)propanamide
CID 18120278
N-(2-acetamidoethyl)-3-[5-(2-fluorophenyl)furan-2-yl]propanamide
CID 30598254
N-[2-(ethylamino)ethyl]-3-[5-(2-fluorophenyl)furan-2-yl]propanamide
CID 119506756
2-[2-[3-[5-(2-fluorophenyl)furan-2-yl]propanoylamino]ethylsulfanyl]acetic acid
CID 119242104
N-[2-[4-(difluoromethoxy)phenyl]ethyl]-3-[5-(2-fluorophenyl)furan-2-yl]propanamide
CID 134041285
N-(3-aminobutyl)-3-[5-(2-fluorophenyl)furan-2-yl]propanamide
CID 119496957
N-[2-[3-[5-(2-fluorophenyl)furan-2-yl]propanoylamino]ethyl]furan-2-carboxamide
CID 24683496
3-[5-(2-fluorophenyl)furan-2-yl]-N-[2-(4-phenylpiperazin-1-yl)ethyl]propanamide
CID 30885363
N-[2-(3,4-dimethoxyphenyl)ethyl]-3-[5-(2-fluorophenyl)furan-2-yl]propanamide
CID 9404529
3-(furan-2-yl)-N-(2-phenoxyethyl)propanamide
CID 78771849
3-[5-(2-fluorophenyl)furan-2-yl]-N-[2-(methylamino)propyl]propanamide;hydrochloride
CID 120827866
N-[2-(cyclopropylamino)-2-oxoethyl]-3-[5-(2-fluorophenyl)furan-2-yl]propanamide
CID 18163857

Frequently Asked Questions

What is the IUPAC name of 3-[5-(2-fluorophenyl)furan-2-yl]-N-(2-phenoxyethyl)propanamide?
The IUPAC name of 3-[5-(2-fluorophenyl)furan-2-yl]-N-(2-phenoxyethyl)propanamide (CID 32934045) is 3-[5-(2-fluorophenyl)furan-2-yl]-N-(2-phenoxyethyl)propanamide.
What is the SMILES notation for 3-[5-(2-fluorophenyl)furan-2-yl]-N-(2-phenoxyethyl)propanamide?
The canonical SMILES for 3-[5-(2-fluorophenyl)furan-2-yl]-N-(2-phenoxyethyl)propanamide is O=C(CCc1ccc(-c2ccccc2F)o1)NCCOc1ccccc1.
What is the InChIKey of 3-[5-(2-fluorophenyl)furan-2-yl]-N-(2-phenoxyethyl)propanamide?
The InChIKey is RLTFNZSHCNUYET-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20FNO3/c22-19-9-5-4-8-18(19)20-12-10-17(26-20)11-13-21(24)23-14-15-25-16-6-2-1-3-7-16/h1-10,12H,11,13-15H2,(H,23,24).
What are the key properties of 3-[5-(2-fluorophenyl)furan-2-yl]-N-(2-phenoxyethyl)propanamide?
3-[5-(2-fluorophenyl)furan-2-yl]-N-(2-phenoxyethyl)propanamide has a molecular weight of 353.39 g/mol, XLogP of 4.21, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[5-(2-fluorophenyl)furan-2-yl]-N-(2-phenoxyethyl)propanamide is sourced from PubChem (CID 32934045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).