N-cyclooctyl-4-fluorobenzamide

C15H20FNO — CID 1484620

IUPACN-cyclooctyl-4-fluorobenzamide
SMILESO=C(NC1CCCCCCC1)c1ccc(F)cc1
InChIInChI=1S/C15H20FNO/c16-13-10-8-12(9-11-13)15(18)17-14-6-4-2-1-3-5-7-14/h8-11,14H,1-7H2,(H,17,18)
InChIKeyOCHZITKAJXOHRF-UHFFFAOYSA-N
MW249.33 g/mol
LogP3.67
Rot. Bonds2

About N-cyclooctyl-4-fluorobenzamide

N-cyclooctyl-4-fluorobenzamide (PubChem CID 1484620) has the molecular formula C15H20FNO and a molecular weight of 249.33 g/mol. Its IUPAC name is N-cyclooctyl-4-fluorobenzamide.

Molecular Properties

Compound NameN-cyclooctyl-4-fluorobenzamide
PubChem CID1484620
Molecular FormulaC15H20FNO
Molecular Weight249.33 g/mol
Exact Mass249.15
IUPAC NameN-cyclooctyl-4-fluorobenzamide
SMILESO=C(NC1CCCCCCC1)c1ccc(F)cc1
InChIInChI=1S/C15H20FNO/c16-13-10-8-12(9-11-13)15(18)17-14-6-4-2-1-3-5-7-14/h8-11,14H,1-7H2,(H,17,18)
InChIKeyOCHZITKAJXOHRF-UHFFFAOYSA-N
XLogP3.67
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.33
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-cyclooctyl-4-fluorobenzamide?
The IUPAC name of N-cyclooctyl-4-fluorobenzamide (CID 1484620) is N-cyclooctyl-4-fluorobenzamide.
What is the SMILES notation for N-cyclooctyl-4-fluorobenzamide?
The canonical SMILES for N-cyclooctyl-4-fluorobenzamide is O=C(NC1CCCCCCC1)c1ccc(F)cc1.
What is the InChIKey of N-cyclooctyl-4-fluorobenzamide?
The InChIKey is OCHZITKAJXOHRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20FNO/c16-13-10-8-12(9-11-13)15(18)17-14-6-4-2-1-3-5-7-14/h8-11,14H,1-7H2,(H,17,18).
What are the key properties of N-cyclooctyl-4-fluorobenzamide?
N-cyclooctyl-4-fluorobenzamide has a molecular weight of 249.33 g/mol, XLogP of 3.67, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclooctyl-4-fluorobenzamide is sourced from PubChem (CID 1484620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).