N-(4-methylphenyl)-3-phenylpropanamide

C16H17NO — CID 778861

IUPACN-(4-methylphenyl)-3-phenylpropanamide
SMILESCc1ccc(NC(=O)CCc2ccccc2)cc1
InChIInChI=1S/C16H17NO/c1-13-7-10-15(11-8-13)17-16(18)12-9-14-5-3-2-4-6-14/h2-8,10-11H,9,12H2,1H3,(H,17,18)
InChIKeyZEPROHGLZFUZOM-UHFFFAOYSA-N
MW239.32 g/mol
LogP3.57
Rot. Bonds4

About N-(4-methylphenyl)-3-phenylpropanamide

N-(4-methylphenyl)-3-phenylpropanamide (PubChem CID 778861) has the molecular formula C16H17NO and a molecular weight of 239.32 g/mol. Its IUPAC name is N-(4-methylphenyl)-3-phenylpropanamide.

Molecular Properties

Compound NameN-(4-methylphenyl)-3-phenylpropanamide
PubChem CID778861
Molecular FormulaC16H17NO
Molecular Weight239.32 g/mol
Exact Mass239.13
IUPAC NameN-(4-methylphenyl)-3-phenylpropanamide
SMILESCc1ccc(NC(=O)CCc2ccccc2)cc1
InChIInChI=1S/C16H17NO/c1-13-7-10-15(11-8-13)17-16(18)12-9-14-5-3-2-4-6-14/h2-8,10-11H,9,12H2,1H3,(H,17,18)
InChIKeyZEPROHGLZFUZOM-UHFFFAOYSA-N
XLogP3.57
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-(4-methylphenyl)-N-phenylpropanamide
CID 2995602
N,3-bis(4-methylphenyl)propanamide
CID 19220434
N-[4-[[2-(methylamino)acetyl]amino]phenyl]-3-phenylpropanamide
CID 54820849
N,N'-bis[4-(3-phenylpropanoylamino)phenyl]pentanediamide
CID 17233797
N-[3-[[2-(4-methylanilino)acetyl]amino]phenyl]-3-phenylpropanamide
CID 54814254
3-phenyl-N-[4-(phenylcarbamoylamino)phenyl]propanamide
CID 17233492
N-(4-hydroxyphenyl)-3-phenylpropanamide
CID 836055
4-methyl-N-[[4-(3-phenylpropanoylamino)phenyl]carbamothioyl]benzamide
CID 17233692
N-[4-[(2-anilinoacetyl)amino]phenyl]-3-phenylpropanamide
CID 54810342
4-(3-phenylpropanoylamino)benzoic acid
CID 10492186
N-[4-(dimethylamino)phenyl]-3-phenylpropanamide
CID 874810
3-phenyl-N-(4-propan-2-ylphenyl)propanamide
CID 819687

Frequently Asked Questions

What is the IUPAC name of N-(4-methylphenyl)-3-phenylpropanamide?
The IUPAC name of N-(4-methylphenyl)-3-phenylpropanamide (CID 778861) is N-(4-methylphenyl)-3-phenylpropanamide.
What is the SMILES notation for N-(4-methylphenyl)-3-phenylpropanamide?
The canonical SMILES for N-(4-methylphenyl)-3-phenylpropanamide is Cc1ccc(NC(=O)CCc2ccccc2)cc1.
What is the InChIKey of N-(4-methylphenyl)-3-phenylpropanamide?
The InChIKey is ZEPROHGLZFUZOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO/c1-13-7-10-15(11-8-13)17-16(18)12-9-14-5-3-2-4-6-14/h2-8,10-11H,9,12H2,1H3,(H,17,18).
What are the key properties of N-(4-methylphenyl)-3-phenylpropanamide?
N-(4-methylphenyl)-3-phenylpropanamide has a molecular weight of 239.32 g/mol, XLogP of 3.57, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylphenyl)-3-phenylpropanamide is sourced from PubChem (CID 778861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).