N-benzyl-5-oxo-5-phenylpentanamide

C18H19NO2 — CID 14428237

IUPACN-benzyl-5-oxo-5-phenylpentanamide
SMILESO=C(CCCC(=O)c1ccccc1)NCc1ccccc1
InChIInChI=1S/C18H19NO2/c20-17(16-10-5-2-6-11-16)12-7-13-18(21)19-14-15-8-3-1-4-9-15/h1-6,8-11H,7,12-14H2,(H,19,21)
InChIKeyLTJCOPRSECXPLY-UHFFFAOYSA-N
MW281.36 g/mol
LogP3.36
Rot. Bonds7

About N-benzyl-5-oxo-5-phenylpentanamide

N-benzyl-5-oxo-5-phenylpentanamide (PubChem CID 14428237) has the molecular formula C18H19NO2 and a molecular weight of 281.36 g/mol. Its IUPAC name is N-benzyl-5-oxo-5-phenylpentanamide.

Molecular Properties

Compound NameN-benzyl-5-oxo-5-phenylpentanamide
PubChem CID14428237
Molecular FormulaC18H19NO2
Molecular Weight281.36 g/mol
Exact Mass281.14
IUPAC NameN-benzyl-5-oxo-5-phenylpentanamide
SMILESO=C(CCCC(=O)c1ccccc1)NCc1ccccc1
InChIInChI=1S/C18H19NO2/c20-17(16-10-5-2-6-11-16)12-7-13-18(21)19-14-15-8-3-1-4-9-15/h1-6,8-11H,7,12-14H2,(H,19,21)
InChIKeyLTJCOPRSECXPLY-UHFFFAOYSA-N
XLogP3.36
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-5-oxo-5-phenylpentanamide?
The IUPAC name of N-benzyl-5-oxo-5-phenylpentanamide (CID 14428237) is N-benzyl-5-oxo-5-phenylpentanamide.
What is the SMILES notation for N-benzyl-5-oxo-5-phenylpentanamide?
The canonical SMILES for N-benzyl-5-oxo-5-phenylpentanamide is O=C(CCCC(=O)c1ccccc1)NCc1ccccc1.
What is the InChIKey of N-benzyl-5-oxo-5-phenylpentanamide?
The InChIKey is LTJCOPRSECXPLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NO2/c20-17(16-10-5-2-6-11-16)12-7-13-18(21)19-14-15-8-3-1-4-9-15/h1-6,8-11H,7,12-14H2,(H,19,21).
What are the key properties of N-benzyl-5-oxo-5-phenylpentanamide?
N-benzyl-5-oxo-5-phenylpentanamide has a molecular weight of 281.36 g/mol, XLogP of 3.36, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-5-oxo-5-phenylpentanamide is sourced from PubChem (CID 14428237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).