N-(3-acetylphenyl)-3-(4-methylphenyl)propanamide

C18H19NO2 — CID 17360048

IUPACN-(3-acetylphenyl)-3-(4-methylphenyl)propanamide
SMILESCC(=O)c1cccc(NC(=O)CCc2ccc(C)cc2)c1
InChIInChI=1S/C18H19NO2/c1-13-6-8-15(9-7-13)10-11-18(21)19-17-5-3-4-16(12-17)14(2)20/h3-9,12H,10-11H2,1-2H3,(H,19,21)
InChIKeyOVCVCLRCSLPHDU-UHFFFAOYSA-N
MW281.36 g/mol
LogP3.77
Rot. Bonds5

About N-(3-acetylphenyl)-3-(4-methylphenyl)propanamide

N-(3-acetylphenyl)-3-(4-methylphenyl)propanamide (PubChem CID 17360048) has the molecular formula C18H19NO2 and a molecular weight of 281.36 g/mol. Its IUPAC name is N-(3-acetylphenyl)-3-(4-methylphenyl)propanamide.

Molecular Properties

Compound NameN-(3-acetylphenyl)-3-(4-methylphenyl)propanamide
PubChem CID17360048
Molecular FormulaC18H19NO2
Molecular Weight281.36 g/mol
Exact Mass281.14
IUPAC NameN-(3-acetylphenyl)-3-(4-methylphenyl)propanamide
SMILESCC(=O)c1cccc(NC(=O)CCc2ccc(C)cc2)c1
InChIInChI=1S/C18H19NO2/c1-13-6-8-15(9-7-13)10-11-18(21)19-17-5-3-4-16(12-17)14(2)20/h3-9,12H,10-11H2,1-2H3,(H,19,21)
InChIKeyOVCVCLRCSLPHDU-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-acetylphenyl)-3-(4-chlorophenyl)propanamide
CID 19220931
propyl 3-[3-(4-methylphenyl)propanoylamino]benzoate
CID 19220462
N-cyclopropyl-3-[3-(4-methylphenyl)propanoylamino]benzamide
CID 18121849
N-[3-(chloromethyl)phenyl]-3-(4-methylphenyl)propanamide
CID 114293248
N-[3-(bromomethyl)phenyl]-3-(4-methylphenyl)propanamide
CID 114307276
3-(4-methylphenyl)-N-phenylpropanamide
CID 2995602
3-acetamido-N-[2-[3-(4-methylphenyl)propanoylamino]ethyl]benzamide
CID 108541864
N,3-bis(4-methylphenyl)propanamide
CID 19220434
4-tert-butyl-N-[3-[3-(4-methylphenyl)propanoylamino]phenyl]benzamide
CID 92681733
N-(3-acetylphenyl)-3-[4-(tert-butylsulfamoyl)phenyl]propanamide
CID 1296104
N-(3-acetylphenyl)-3-pyridin-3-ylpropanamide
CID 9209643
N-(3-acetylphenyl)-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide
CID 9244621

Frequently Asked Questions

What is the IUPAC name of N-(3-acetylphenyl)-3-(4-methylphenyl)propanamide?
The IUPAC name of N-(3-acetylphenyl)-3-(4-methylphenyl)propanamide (CID 17360048) is N-(3-acetylphenyl)-3-(4-methylphenyl)propanamide.
What is the SMILES notation for N-(3-acetylphenyl)-3-(4-methylphenyl)propanamide?
The canonical SMILES for N-(3-acetylphenyl)-3-(4-methylphenyl)propanamide is CC(=O)c1cccc(NC(=O)CCc2ccc(C)cc2)c1.
What is the InChIKey of N-(3-acetylphenyl)-3-(4-methylphenyl)propanamide?
The InChIKey is OVCVCLRCSLPHDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NO2/c1-13-6-8-15(9-7-13)10-11-18(21)19-17-5-3-4-16(12-17)14(2)20/h3-9,12H,10-11H2,1-2H3,(H,19,21).
What are the key properties of N-(3-acetylphenyl)-3-(4-methylphenyl)propanamide?
N-(3-acetylphenyl)-3-(4-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-(3-acetylphenyl)-3-(4-methylphenyl)propanamide is sourced from PubChem (CID 17360048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).