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

C17H19NO3 — CID 941877

IUPACN-(4-acetylphenyl)-3-(5-ethylfuran-2-yl)propanamide
SMILESCCc1ccc(CCC(=O)Nc2ccc(C(C)=O)cc2)o1
InChIInChI=1S/C17H19NO3/c1-3-15-8-9-16(21-15)10-11-17(20)18-14-6-4-13(5-7-14)12(2)19/h4-9H,3,10-11H2,1-2H3,(H,18,20)
InChIKeyLYPSJXFSEXNQFY-UHFFFAOYSA-N
MW285.34 g/mol
LogP3.62
Rot. Bonds6

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

N-(4-acetylphenyl)-3-(5-ethylfuran-2-yl)propanamide (PubChem CID 941877) has the molecular formula C17H19NO3 and a molecular weight of 285.34 g/mol. Its IUPAC name is N-(4-acetylphenyl)-3-(5-ethylfuran-2-yl)propanamide.

Molecular Properties

Compound NameN-(4-acetylphenyl)-3-(5-ethylfuran-2-yl)propanamide
PubChem CID941877
Molecular FormulaC17H19NO3
Molecular Weight285.34 g/mol
Exact Mass285.14
IUPAC NameN-(4-acetylphenyl)-3-(5-ethylfuran-2-yl)propanamide
SMILESCCc1ccc(CCC(=O)Nc2ccc(C(C)=O)cc2)o1
InChIInChI=1S/C17H19NO3/c1-3-15-8-9-16(21-15)10-11-17(20)18-14-6-4-13(5-7-14)12(2)19/h4-9H,3,10-11H2,1-2H3,(H,18,20)
InChIKeyLYPSJXFSEXNQFY-UHFFFAOYSA-N
XLogP3.62
TPSA59.31 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.34
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-acetylphenyl)-3-(5-ethylfuran-2-yl)propanamide?
The IUPAC name of N-(4-acetylphenyl)-3-(5-ethylfuran-2-yl)propanamide (CID 941877) is N-(4-acetylphenyl)-3-(5-ethylfuran-2-yl)propanamide.
What is the SMILES notation for N-(4-acetylphenyl)-3-(5-ethylfuran-2-yl)propanamide?
The canonical SMILES for N-(4-acetylphenyl)-3-(5-ethylfuran-2-yl)propanamide is CCc1ccc(CCC(=O)Nc2ccc(C(C)=O)cc2)o1.
What is the InChIKey of N-(4-acetylphenyl)-3-(5-ethylfuran-2-yl)propanamide?
The InChIKey is LYPSJXFSEXNQFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO3/c1-3-15-8-9-16(21-15)10-11-17(20)18-14-6-4-13(5-7-14)12(2)19/h4-9H,3,10-11H2,1-2H3,(H,18,20).
What are the key properties of N-(4-acetylphenyl)-3-(5-ethylfuran-2-yl)propanamide?
N-(4-acetylphenyl)-3-(5-ethylfuran-2-yl)propanamide has a molecular weight of 285.34 g/mol, XLogP of 3.62, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetylphenyl)-3-(5-ethylfuran-2-yl)propanamide is sourced from PubChem (CID 941877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).