N-[(4-fluorophenyl)methyl]-8-oxooctanamide

C15H20FNO2 — CID 90932899

IUPACN-[(4-fluorophenyl)methyl]-8-oxooctanamide
SMILESO=CCCCCCCC(=O)NCc1ccc(F)cc1
InChIInChI=1S/C15H20FNO2/c16-14-9-7-13(8-10-14)12-17-15(19)6-4-2-1-3-5-11-18/h7-11H,1-6,12H2,(H,17,19)
InChIKeyMAGJDIJBBFJOLU-UHFFFAOYSA-N
MW265.33 g/mol
LogP2.98
Rot. Bonds9

About N-[(4-fluorophenyl)methyl]-8-oxooctanamide

N-[(4-fluorophenyl)methyl]-8-oxooctanamide (PubChem CID 90932899) has the molecular formula C15H20FNO2 and a molecular weight of 265.33 g/mol. Its IUPAC name is N-[(4-fluorophenyl)methyl]-8-oxooctanamide.

Molecular Properties

Compound NameN-[(4-fluorophenyl)methyl]-8-oxooctanamide
PubChem CID90932899
Molecular FormulaC15H20FNO2
Molecular Weight265.33 g/mol
Exact Mass265.15
IUPAC NameN-[(4-fluorophenyl)methyl]-8-oxooctanamide
SMILESO=CCCCCCCC(=O)NCc1ccc(F)cc1
InChIInChI=1S/C15H20FNO2/c16-14-9-7-13(8-10-14)12-17-15(19)6-4-2-1-3-5-11-18/h7-11H,1-6,12H2,(H,17,19)
InChIKeyMAGJDIJBBFJOLU-UHFFFAOYSA-N
XLogP2.98
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.33
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[(4-fluorophenyl)methyl]-5-hydroxypentanamide
CID 79199621
N-benzyl-6-oxohexanamide
CID 172715262
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CID 110297766
N-[(4-fluorophenyl)methyl]-2-[(4-fluorophenyl)methylamino]acetamide
CID 108997698
3-bromo-N-[(4-fluorophenyl)methyl]propanamide
CID 82109688
N-benzyl-N'-[(4-fluorophenyl)methyl]butanediamide
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N-[(4-fluorophenyl)methyl]-5-thiophen-2-ylpentanamide
CID 110297704
18-hydroxy-N-[[4-[(18-hydroxyoctadecanoylamino)methyl]phenyl]methyl]octadecanamide
CID 101321590
N-[[4-[(octanoylamino)methyl]phenyl]methyl]octanamide
CID 3350050
N-[4-[(7-aminoheptanoylamino)methyl]phenyl]-4-fluorobenzamide
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3-[(4-fluorophenyl)methylamino]-3-oxopropanoic acid
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2-chloro-N-[(4-fluorophenyl)methyl]acetamide
CID 2303709

Frequently Asked Questions

What is the IUPAC name of N-[(4-fluorophenyl)methyl]-8-oxooctanamide?
The IUPAC name of N-[(4-fluorophenyl)methyl]-8-oxooctanamide (CID 90932899) is N-[(4-fluorophenyl)methyl]-8-oxooctanamide.
What is the SMILES notation for N-[(4-fluorophenyl)methyl]-8-oxooctanamide?
The canonical SMILES for N-[(4-fluorophenyl)methyl]-8-oxooctanamide is O=CCCCCCCC(=O)NCc1ccc(F)cc1.
What is the InChIKey of N-[(4-fluorophenyl)methyl]-8-oxooctanamide?
The InChIKey is MAGJDIJBBFJOLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20FNO2/c16-14-9-7-13(8-10-14)12-17-15(19)6-4-2-1-3-5-11-18/h7-11H,1-6,12H2,(H,17,19).
What are the key properties of N-[(4-fluorophenyl)methyl]-8-oxooctanamide?
N-[(4-fluorophenyl)methyl]-8-oxooctanamide has a molecular weight of 265.33 g/mol, XLogP of 2.98, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-fluorophenyl)methyl]-8-oxooctanamide is sourced from PubChem (CID 90932899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).