N-ethyl-5-(4-methoxyphenyl)-N-(3-methylphenyl)-5-oxopentanamide

C21H25NO3 — CID 110298284

IUPACN-ethyl-5-(4-methoxyphenyl)-N-(3-methylphenyl)-5-oxopentanamide
SMILESCCN(C(=O)CCCC(=O)c1ccc(OC)cc1)c1cccc(C)c1
InChIInChI=1S/C21H25NO3/c1-4-22(18-8-5-7-16(2)15-18)21(24)10-6-9-20(23)17-11-13-19(25-3)14-12-17/h5,7-8,11-15H,4,6,9-10H2,1-3H3
InChIKeyJOPUOILIHYJSDA-UHFFFAOYSA-N
MW339.44 g/mol
LogP4.41
Rot. Bonds8

About N-ethyl-5-(4-methoxyphenyl)-N-(3-methylphenyl)-5-oxopentanamide

N-ethyl-5-(4-methoxyphenyl)-N-(3-methylphenyl)-5-oxopentanamide (PubChem CID 110298284) has the molecular formula C21H25NO3 and a molecular weight of 339.44 g/mol. Its IUPAC name is N-ethyl-5-(4-methoxyphenyl)-N-(3-methylphenyl)-5-oxopentanamide.

Molecular Properties

Compound NameN-ethyl-5-(4-methoxyphenyl)-N-(3-methylphenyl)-5-oxopentanamide
PubChem CID110298284
Molecular FormulaC21H25NO3
Molecular Weight339.44 g/mol
Exact Mass339.18
IUPAC NameN-ethyl-5-(4-methoxyphenyl)-N-(3-methylphenyl)-5-oxopentanamide
SMILESCCN(C(=O)CCCC(=O)c1ccc(OC)cc1)c1cccc(C)c1
InChIInChI=1S/C21H25NO3/c1-4-22(18-8-5-7-16(2)15-18)21(24)10-6-9-20(23)17-11-13-19(25-3)14-12-17/h5,7-8,11-15H,4,6,9-10H2,1-3H3
InChIKeyJOPUOILIHYJSDA-UHFFFAOYSA-N
XLogP4.41
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 54.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-5-(4-methoxyphenyl)-5-oxo-N-phenylpentanamide
CID 110298239
N-ethyl-N-(3-methylphenyl)-4-(4-methylphenyl)-4-oxobutanamide
CID 110295025
5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-ethyl-N-(3-methylphenyl)-5-oxopentanamide
CID 110344639
3-amino-N-ethyl-N-(3-methylphenyl)propanamide
CID 22692119
5-(4-methoxyphenyl)-N-methyl-5-oxo-N-phenylpentanamide
CID 110298230
ethyl 4-(N-ethyl-3-methylanilino)-4-oxobutanoate
CID 60737731
3-(4-methoxyphenyl)-N-(3-methylphenyl)-N-propylpropanamide
CID 17321844
N-ethyl-N-(3-methylphenyl)-3-phenoxypropanamide
CID 113099032
3-[butyl(methyl)amino]-N-ethyl-N-(3-methylphenyl)propanamide
CID 109032470
N-ethyl-2-[4-(4-methoxyphenyl)-6-oxopyrimidin-1-yl]-N-(3-methylphenyl)acetamide
CID 121063850
N-ethyl-N'-(4-methoxyphenyl)-2,2-dimethyl-N-(3-methylphenyl)propanediamide
CID 108969447
N-ethyl-3-(N-ethylanilino)-N-(3-methylphenyl)propanamide
CID 109036586

Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-(4-methoxyphenyl)-N-(3-methylphenyl)-5-oxopentanamide?
The IUPAC name of N-ethyl-5-(4-methoxyphenyl)-N-(3-methylphenyl)-5-oxopentanamide (CID 110298284) is N-ethyl-5-(4-methoxyphenyl)-N-(3-methylphenyl)-5-oxopentanamide.
What is the SMILES notation for N-ethyl-5-(4-methoxyphenyl)-N-(3-methylphenyl)-5-oxopentanamide?
The canonical SMILES for N-ethyl-5-(4-methoxyphenyl)-N-(3-methylphenyl)-5-oxopentanamide is CCN(C(=O)CCCC(=O)c1ccc(OC)cc1)c1cccc(C)c1.
What is the InChIKey of N-ethyl-5-(4-methoxyphenyl)-N-(3-methylphenyl)-5-oxopentanamide?
The InChIKey is JOPUOILIHYJSDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25NO3/c1-4-22(18-8-5-7-16(2)15-18)21(24)10-6-9-20(23)17-11-13-19(25-3)14-12-17/h5,7-8,11-15H,4,6,9-10H2,1-3H3.
What are the key properties of N-ethyl-5-(4-methoxyphenyl)-N-(3-methylphenyl)-5-oxopentanamide?
N-ethyl-5-(4-methoxyphenyl)-N-(3-methylphenyl)-5-oxopentanamide has a molecular weight of 339.44 g/mol, XLogP of 4.41, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-(4-methoxyphenyl)-N-(3-methylphenyl)-5-oxopentanamide is sourced from PubChem (CID 110298284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).