N-(2-acetylphenyl)-3-(3-methylphenyl)propanamide

C18H19NO2 — CID 60700220

IUPACN-(2-acetylphenyl)-3-(3-methylphenyl)propanamide
SMILESCC(=O)c1ccccc1NC(=O)CCc1cccc(C)c1
InChIInChI=1S/C18H19NO2/c1-13-6-5-7-15(12-13)10-11-18(21)19-17-9-4-3-8-16(17)14(2)20/h3-9,12H,10-11H2,1-2H3,(H,19,21)
InChIKeyYMBLPPDJZXVJRK-UHFFFAOYSA-N
MW281.36 g/mol
LogP3.77
Rot. Bonds5

About N-(2-acetylphenyl)-3-(3-methylphenyl)propanamide

N-(2-acetylphenyl)-3-(3-methylphenyl)propanamide (PubChem CID 60700220) has the molecular formula C18H19NO2 and a molecular weight of 281.36 g/mol. Its IUPAC name is N-(2-acetylphenyl)-3-(3-methylphenyl)propanamide.

Molecular Properties

Compound NameN-(2-acetylphenyl)-3-(3-methylphenyl)propanamide
PubChem CID60700220
Molecular FormulaC18H19NO2
Molecular Weight281.36 g/mol
Exact Mass281.14
IUPAC NameN-(2-acetylphenyl)-3-(3-methylphenyl)propanamide
SMILESCC(=O)c1ccccc1NC(=O)CCc1cccc(C)c1
InChIInChI=1S/C18H19NO2/c1-13-6-5-7-15(12-13)10-11-18(21)19-17-9-4-3-8-16(17)14(2)20/h3-9,12H,10-11H2,1-2H3,(H,19,21)
InChIKeyYMBLPPDJZXVJRK-UHFFFAOYSA-N
XLogP3.77
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-methoxyphenyl)-2-[3-(3-methylphenyl)propanoylamino]benzamide
CID 55456678
N-(2-hydroxy-4-methylphenyl)-3-(3-methylphenyl)propanamide
CID 47128848
N-(2-bromo-5-methylphenyl)-3-(3-methylphenyl)propanamide
CID 82706258
N-(2-bromo-3-chlorophenyl)-3-(3-methylphenyl)propanamide
CID 103479751
2-[3-[4-(3-methylphenyl)phenyl]propanoylamino]benzoic acid
CID 11710202
N-(4-amino-2-chlorophenyl)-3-(3-methylphenyl)propanamide
CID 62367069
2-[3-(1,3-benzodioxol-5-yl)propanoylamino]-N-(3-methylphenyl)benzamide
CID 24555317
N-(2,6-difluorophenyl)-3-(3-methylphenyl)propanamide
CID 51277484
2-[3-(3-aminophenyl)propanoylamino]benzoic acid
CID 115341270
2-[3-(3-fluorophenyl)propanoylamino]benzamide
CID 110675454
2-[3-(3-chlorophenyl)propanoylamino]-N-methylbenzamide
CID 110606621
N-(2-amino-5-chlorophenyl)-3-(3-methylphenyl)propanamide
CID 62366718

Frequently Asked Questions

What is the IUPAC name of N-(2-acetylphenyl)-3-(3-methylphenyl)propanamide?
The IUPAC name of N-(2-acetylphenyl)-3-(3-methylphenyl)propanamide (CID 60700220) is N-(2-acetylphenyl)-3-(3-methylphenyl)propanamide.
What is the SMILES notation for N-(2-acetylphenyl)-3-(3-methylphenyl)propanamide?
The canonical SMILES for N-(2-acetylphenyl)-3-(3-methylphenyl)propanamide is CC(=O)c1ccccc1NC(=O)CCc1cccc(C)c1.
What is the InChIKey of N-(2-acetylphenyl)-3-(3-methylphenyl)propanamide?
The InChIKey is YMBLPPDJZXVJRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NO2/c1-13-6-5-7-15(12-13)10-11-18(21)19-17-9-4-3-8-16(17)14(2)20/h3-9,12H,10-11H2,1-2H3,(H,19,21).
What are the key properties of N-(2-acetylphenyl)-3-(3-methylphenyl)propanamide?
N-(2-acetylphenyl)-3-(3-methylphenyl)propanamide has a molecular weight of 281.36 g/mol, XLogP of 3.77, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-acetylphenyl)-3-(3-methylphenyl)propanamide is sourced from PubChem (CID 60700220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).