N-benzyl-3-phenylpropanamide

C16H17NO — CID 730453

IUPACN-benzyl-3-phenylpropanamide
SMILESO=C(CCc1ccccc1)NCc1ccccc1
InChIInChI=1S/C16H17NO/c18-16(12-11-14-7-3-1-4-8-14)17-13-15-9-5-2-6-10-15/h1-10H,11-13H2,(H,17,18)
InChIKeyFEOUTXCSJHUHLP-UHFFFAOYSA-N
MW239.32 g/mol
LogP2.94
Rot. Bonds5

About N-benzyl-3-phenylpropanamide

N-benzyl-3-phenylpropanamide (PubChem CID 730453) has the molecular formula C16H17NO and a molecular weight of 239.32 g/mol. Its IUPAC name is N-benzyl-3-phenylpropanamide.

Molecular Properties

Compound NameN-benzyl-3-phenylpropanamide
PubChem CID730453
Molecular FormulaC16H17NO
Molecular Weight239.32 g/mol
Exact Mass239.13
IUPAC NameN-benzyl-3-phenylpropanamide
SMILESO=C(CCc1ccccc1)NCc1ccccc1
InChIInChI=1S/C16H17NO/c18-16(12-11-14-7-3-1-4-8-14)17-13-15-9-5-2-6-10-15/h1-10H,11-13H2,(H,17,18)
InChIKeyFEOUTXCSJHUHLP-UHFFFAOYSA-N
XLogP2.94
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-3-phenylpropanamide?
The IUPAC name of N-benzyl-3-phenylpropanamide (CID 730453) is N-benzyl-3-phenylpropanamide.
What is the SMILES notation for N-benzyl-3-phenylpropanamide?
The canonical SMILES for N-benzyl-3-phenylpropanamide is O=C(CCc1ccccc1)NCc1ccccc1.
What is the InChIKey of N-benzyl-3-phenylpropanamide?
The InChIKey is FEOUTXCSJHUHLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO/c18-16(12-11-14-7-3-1-4-8-14)17-13-15-9-5-2-6-10-15/h1-10H,11-13H2,(H,17,18).
What are the key properties of N-benzyl-3-phenylpropanamide?
N-benzyl-3-phenylpropanamide has a molecular weight of 239.32 g/mol, XLogP of 2.94, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-3-phenylpropanamide is sourced from PubChem (CID 730453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).