3-[5-(4-methoxyphenyl)furan-2-yl]-N-propylpropanamide

C17H21NO3 — CID 22587421

IUPAC3-[5-(4-methoxyphenyl)furan-2-yl]-N-propylpropanamide
SMILESCCCNC(=O)CCc1ccc(-c2ccc(OC)cc2)o1
InChIInChI=1S/C17H21NO3/c1-3-12-18-17(19)11-9-15-8-10-16(21-15)13-4-6-14(20-2)7-5-13/h4-8,10H,3,9,11-12H2,1-2H3,(H,18,19)
InChIKeyCHXKTFMTUZTOBM-UHFFFAOYSA-N
MW287.36 g/mol
LogP3.41
Rot. Bonds7

About 3-[5-(4-methoxyphenyl)furan-2-yl]-N-propylpropanamide

3-[5-(4-methoxyphenyl)furan-2-yl]-N-propylpropanamide (PubChem CID 22587421) has the molecular formula C17H21NO3 and a molecular weight of 287.36 g/mol. Its IUPAC name is 3-[5-(4-methoxyphenyl)furan-2-yl]-N-propylpropanamide.

Molecular Properties

Compound Name3-[5-(4-methoxyphenyl)furan-2-yl]-N-propylpropanamide
PubChem CID22587421
Molecular FormulaC17H21NO3
Molecular Weight287.36 g/mol
Exact Mass287.15
IUPAC Name3-[5-(4-methoxyphenyl)furan-2-yl]-N-propylpropanamide
SMILESCCCNC(=O)CCc1ccc(-c2ccc(OC)cc2)o1
InChIInChI=1S/C17H21NO3/c1-3-12-18-17(19)11-9-15-8-10-16(21-15)13-4-6-14(20-2)7-5-13/h4-8,10H,3,9,11-12H2,1-2H3,(H,18,19)
InChIKeyCHXKTFMTUZTOBM-UHFFFAOYSA-N
XLogP3.41
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(3,4-dimethoxyphenyl)ethyl]-3-[5-(4-methoxyphenyl)furan-2-yl]propanamide
CID 27286046
N-[(2,5-dimethoxyphenyl)methyl]-3-[5-(4-methoxyphenyl)furan-2-yl]propanamide
CID 33113653
N-(3,5-dimethylphenyl)-3-[5-(4-methoxyphenyl)furan-2-yl]propanamide
CID 22587459
N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-3-(5-phenylfuran-2-yl)propanamide
CID 42959591
N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-3-[5-(4-methoxyphenyl)furan-2-yl]propanamide
CID 4972255
N-(2-methoxy-5-methylphenyl)-3-[5-(4-methoxyphenyl)furan-2-yl]propanamide
CID 24524655
3-[5-(4-methoxyphenyl)furan-2-yl]-N-(4-methyl-1,3-thiazol-2-yl)propanamide
CID 24524663
ethyl 5-(dimethylcarbamoyl)-2-[3-[5-(4-methoxyphenyl)furan-2-yl]propanoylamino]-4-methylthiophene-3-carboxylate
CID 154859579
N-(3-phenoxypropyl)-3-(5-phenylfuran-2-yl)propanamide
CID 18120278
3-[5-(4-methoxyphenyl)furan-2-yl]-N-[(1R)-1-(4-methylsulfonylphenyl)ethyl]propanamide
CID 26010955
N-[1-(3-fluoro-4-methoxyphenyl)ethyl]-3-[5-(4-methoxyphenyl)furan-2-yl]propanamide
CID 42921818
N-[1-(2,4-difluorophenyl)ethyl]-3-[5-(4-methoxyphenyl)furan-2-yl]propanamide
CID 42921779

Frequently Asked Questions

What is the IUPAC name of 3-[5-(4-methoxyphenyl)furan-2-yl]-N-propylpropanamide?
The IUPAC name of 3-[5-(4-methoxyphenyl)furan-2-yl]-N-propylpropanamide (CID 22587421) is 3-[5-(4-methoxyphenyl)furan-2-yl]-N-propylpropanamide.
What is the SMILES notation for 3-[5-(4-methoxyphenyl)furan-2-yl]-N-propylpropanamide?
The canonical SMILES for 3-[5-(4-methoxyphenyl)furan-2-yl]-N-propylpropanamide is CCCNC(=O)CCc1ccc(-c2ccc(OC)cc2)o1.
What is the InChIKey of 3-[5-(4-methoxyphenyl)furan-2-yl]-N-propylpropanamide?
The InChIKey is CHXKTFMTUZTOBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO3/c1-3-12-18-17(19)11-9-15-8-10-16(21-15)13-4-6-14(20-2)7-5-13/h4-8,10H,3,9,11-12H2,1-2H3,(H,18,19).
What are the key properties of 3-[5-(4-methoxyphenyl)furan-2-yl]-N-propylpropanamide?
3-[5-(4-methoxyphenyl)furan-2-yl]-N-propylpropanamide has a molecular weight of 287.36 g/mol, XLogP of 3.41, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[5-(4-methoxyphenyl)furan-2-yl]-N-propylpropanamide is sourced from PubChem (CID 22587421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).