4-(3-phenylpropyl)benzamide

C16H17NO — CID 122184328

IUPAC4-(3-phenylpropyl)benzamide
SMILESNC(=O)c1ccc(CCCc2ccccc2)cc1
InChIInChI=1S/C16H17NO/c17-16(18)15-11-9-14(10-12-15)8-4-7-13-5-2-1-3-6-13/h1-3,5-6,9-12H,4,7-8H2,(H2,17,18)
InChIKeyNZYADVIYOXKOIM-UHFFFAOYSA-N
MW239.32 g/mol
LogP2.96
Rot. Bonds5

About 4-(3-phenylpropyl)benzamide

4-(3-phenylpropyl)benzamide (PubChem CID 122184328) has the molecular formula C16H17NO and a molecular weight of 239.32 g/mol. Its IUPAC name is 4-(3-phenylpropyl)benzamide.

Molecular Properties

Compound Name4-(3-phenylpropyl)benzamide
PubChem CID122184328
Molecular FormulaC16H17NO
Molecular Weight239.32 g/mol
Exact Mass239.13
IUPAC Name4-(3-phenylpropyl)benzamide
SMILESNC(=O)c1ccc(CCCc2ccccc2)cc1
InChIInChI=1S/C16H17NO/c17-16(18)15-11-9-14(10-12-15)8-4-7-13-5-2-1-3-6-13/h1-3,5-6,9-12H,4,7-8H2,(H2,17,18)
InChIKeyNZYADVIYOXKOIM-UHFFFAOYSA-N
XLogP2.96
TPSA43.09 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 ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-(3-phenylpropyl)benzamide?
The IUPAC name of 4-(3-phenylpropyl)benzamide (CID 122184328) is 4-(3-phenylpropyl)benzamide.
What is the SMILES notation for 4-(3-phenylpropyl)benzamide?
The canonical SMILES for 4-(3-phenylpropyl)benzamide is NC(=O)c1ccc(CCCc2ccccc2)cc1.
What is the InChIKey of 4-(3-phenylpropyl)benzamide?
The InChIKey is NZYADVIYOXKOIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO/c17-16(18)15-11-9-14(10-12-15)8-4-7-13-5-2-1-3-6-13/h1-3,5-6,9-12H,4,7-8H2,(H2,17,18).
What are the key properties of 4-(3-phenylpropyl)benzamide?
4-(3-phenylpropyl)benzamide has a molecular weight of 239.32 g/mol, XLogP of 2.96, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-phenylpropyl)benzamide is sourced from PubChem (CID 122184328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).