2-[(4-fluorophenyl)methoxy]-N-[(E)-oct-6-enyl]acetamide

C17H24FNO2 — CID 143299293

IUPAC2-[(4-fluorophenyl)methoxy]-N-[(E)-oct-6-enyl]acetamide
SMILESC/C=C/CCCCCNC(=O)COCc1ccc(F)cc1
InChIInChI=1S/C17H24FNO2/c1-2-3-4-5-6-7-12-19-17(20)14-21-13-15-8-10-16(18)11-9-15/h2-3,8-11H,4-7,12-14H2,1H3,(H,19,20)/b3-2+
InChIKeyUGNGXDDWFNAEDT-NSCUHMNNSA-N
MW293.38 g/mol
LogP3.60
Rot. Bonds10

About 2-[(4-fluorophenyl)methoxy]-N-[(E)-oct-6-enyl]acetamide

2-[(4-fluorophenyl)methoxy]-N-[(E)-oct-6-enyl]acetamide (PubChem CID 143299293) has the molecular formula C17H24FNO2 and a molecular weight of 293.38 g/mol. Its IUPAC name is 2-[(4-fluorophenyl)methoxy]-N-[(E)-oct-6-enyl]acetamide.

Molecular Properties

Compound Name2-[(4-fluorophenyl)methoxy]-N-[(E)-oct-6-enyl]acetamide
PubChem CID143299293
Molecular FormulaC17H24FNO2
Molecular Weight293.38 g/mol
Exact Mass293.18
IUPAC Name2-[(4-fluorophenyl)methoxy]-N-[(E)-oct-6-enyl]acetamide
SMILESC/C=C/CCCCCNC(=O)COCc1ccc(F)cc1
InChIInChI=1S/C17H24FNO2/c1-2-3-4-5-6-7-12-19-17(20)14-21-13-15-8-10-16(18)11-9-15/h2-3,8-11H,4-7,12-14H2,1H3,(H,19,20)/b3-2+
InChIKeyUGNGXDDWFNAEDT-NSCUHMNNSA-N
XLogP3.60
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.38
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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CID 2897080

Frequently Asked Questions

What is the IUPAC name of 2-[(4-fluorophenyl)methoxy]-N-[(E)-oct-6-enyl]acetamide?
The IUPAC name of 2-[(4-fluorophenyl)methoxy]-N-[(E)-oct-6-enyl]acetamide (CID 143299293) is 2-[(4-fluorophenyl)methoxy]-N-[(E)-oct-6-enyl]acetamide.
What is the SMILES notation for 2-[(4-fluorophenyl)methoxy]-N-[(E)-oct-6-enyl]acetamide?
The canonical SMILES for 2-[(4-fluorophenyl)methoxy]-N-[(E)-oct-6-enyl]acetamide is C/C=C/CCCCCNC(=O)COCc1ccc(F)cc1.
What is the InChIKey of 2-[(4-fluorophenyl)methoxy]-N-[(E)-oct-6-enyl]acetamide?
The InChIKey is UGNGXDDWFNAEDT-NSCUHMNNSA-N. The full InChI is InChI=1S/C17H24FNO2/c1-2-3-4-5-6-7-12-19-17(20)14-21-13-15-8-10-16(18)11-9-15/h2-3,8-11H,4-7,12-14H2,1H3,(H,19,20)/b3-2+.
What are the key properties of 2-[(4-fluorophenyl)methoxy]-N-[(E)-oct-6-enyl]acetamide?
2-[(4-fluorophenyl)methoxy]-N-[(E)-oct-6-enyl]acetamide has a molecular weight of 293.38 g/mol, XLogP of 3.60, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-fluorophenyl)methoxy]-N-[(E)-oct-6-enyl]acetamide is sourced from PubChem (CID 143299293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).