N-(3-benzylphenyl)propanamide

C16H17NO — CID 70797974

IUPACN-(3-benzylphenyl)propanamide
SMILESCCC(=O)Nc1cccc(Cc2ccccc2)c1
InChIInChI=1S/C16H17NO/c1-2-16(18)17-15-10-6-9-14(12-15)11-13-7-4-3-5-8-13/h3-10,12H,2,11H2,1H3,(H,17,18)
InChIKeyZKFLXXLOXPSMLX-UHFFFAOYSA-N
MW239.32 g/mol
LogP3.63
Rot. Bonds4

About N-(3-benzylphenyl)propanamide

N-(3-benzylphenyl)propanamide (PubChem CID 70797974) has the molecular formula C16H17NO and a molecular weight of 239.32 g/mol. Its IUPAC name is N-(3-benzylphenyl)propanamide.

Molecular Properties

Compound NameN-(3-benzylphenyl)propanamide
PubChem CID70797974
Molecular FormulaC16H17NO
Molecular Weight239.32 g/mol
Exact Mass239.13
IUPAC NameN-(3-benzylphenyl)propanamide
SMILESCCC(=O)Nc1cccc(Cc2ccccc2)c1
InChIInChI=1S/C16H17NO/c1-2-16(18)17-15-10-6-9-14(12-15)11-13-7-4-3-5-8-13/h3-10,12H,2,11H2,1H3,(H,17,18)
InChIKeyZKFLXXLOXPSMLX-UHFFFAOYSA-N
XLogP3.63
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 ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[3-(hydroxymethyl)phenyl]propanamide
CID 12959862
N-(3-benzylphenyl)-3-hydroxypropanamide
CID 142480004
N-[3-[[3-(hexanoylamino)phenyl]methyl]phenyl]hexanamide
CID 101187552
S-[[3-(propanoylamino)phenyl]methyl] ethanethioate
CID 58860370
ethane;methane;N-phenylpropanamide
CID 159778408
N-[4-[(2-phenylacetyl)amino]phenyl]propanamide
CID 1274275
N-[3-(dibenzylcarbamothioylamino)phenyl]propanamide
CID 17382537
3-iodo-N-[3-[[3-(3-iodopropanoylamino)phenyl]methyl]phenyl]propanamide
CID 139955285
N-(3-acetylphenyl)propanamide
CID 903063
N-benzyl-N-ethyl-3-(propanoylamino)benzamide
CID 17309573
N,N'-bis[3-(propanoylamino)phenyl]nonanediamide
CID 17188809
N-[3-[[2-oxo-2-[4-(propanoylamino)anilino]ethyl]amino]phenyl]-3-phenylpropanamide
CID 54837505

Frequently Asked Questions

What is the IUPAC name of N-(3-benzylphenyl)propanamide?
The IUPAC name of N-(3-benzylphenyl)propanamide (CID 70797974) is N-(3-benzylphenyl)propanamide.
What is the SMILES notation for N-(3-benzylphenyl)propanamide?
The canonical SMILES for N-(3-benzylphenyl)propanamide is CCC(=O)Nc1cccc(Cc2ccccc2)c1.
What is the InChIKey of N-(3-benzylphenyl)propanamide?
The InChIKey is ZKFLXXLOXPSMLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO/c1-2-16(18)17-15-10-6-9-14(12-15)11-13-7-4-3-5-8-13/h3-10,12H,2,11H2,1H3,(H,17,18).
What are the key properties of N-(3-benzylphenyl)propanamide?
N-(3-benzylphenyl)propanamide has a molecular weight of 239.32 g/mol, XLogP of 3.63, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-benzylphenyl)propanamide is sourced from PubChem (CID 70797974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).