5-fluoro-2-hydroxy-N-(8-oxononyl)benzamide

C16H22FNO3 — CID 59140674

IUPAC5-fluoro-2-hydroxy-N-(8-oxononyl)benzamide
SMILESCC(=O)CCCCCCCNC(=O)c1cc(F)ccc1O
InChIInChI=1S/C16H22FNO3/c1-12(19)7-5-3-2-4-6-10-18-16(21)14-11-13(17)8-9-15(14)20/h8-9,11,20H,2-7,10H2,1H3,(H,18,21)
InChIKeyQEDQBJNDGKHQIY-UHFFFAOYSA-N
MW295.35 g/mol
LogP3.19
Rot. Bonds9

About 5-fluoro-2-hydroxy-N-(8-oxononyl)benzamide

5-fluoro-2-hydroxy-N-(8-oxononyl)benzamide (PubChem CID 59140674) has the molecular formula C16H22FNO3 and a molecular weight of 295.35 g/mol. Its IUPAC name is 5-fluoro-2-hydroxy-N-(8-oxononyl)benzamide.

Molecular Properties

Compound Name5-fluoro-2-hydroxy-N-(8-oxononyl)benzamide
PubChem CID59140674
Molecular FormulaC16H22FNO3
Molecular Weight295.35 g/mol
Exact Mass295.16
IUPAC Name5-fluoro-2-hydroxy-N-(8-oxononyl)benzamide
SMILESCC(=O)CCCCCCCNC(=O)c1cc(F)ccc1O
InChIInChI=1S/C16H22FNO3/c1-12(19)7-5-3-2-4-6-10-18-16(21)14-11-13(17)8-9-15(14)20/h8-9,11,20H,2-7,10H2,1H3,(H,18,21)
InChIKeyQEDQBJNDGKHQIY-UHFFFAOYSA-N
XLogP3.19
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.35
LogP ≤ 53.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

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CID 106843460
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CID 21335630
5-fluoro-2-hydroxy-N-(2-hydroxyethyl)benzamide
CID 67742481
5-fluoro-2-hydroxy-N-[3-(methylamino)-3-oxopropyl]benzamide
CID 79881248
7-[(5-fluoro-2-methylbenzoyl)amino]heptanoic acid
CID 62034426
N-ethyl-5-fluoro-2-hydroxybenzamide
CID 79531934
N-(5-amino-5-oxopentyl)-5-fluoro-2-methylbenzamide
CID 84594465
5-fluoro-N-[9-[4-[1-[9-[(5-fluoro-2-hydroxybenzoyl)amino]nonyl]piperidin-4-yl]oxypiperidin-1-yl]nonyl]-2-hydroxybenzamide
CID 142786438
4-[(4-fluoro-2-hydroxybenzoyl)amino]butanoic acid
CID 107013327
2,5-difluoro-N-undecylbenzamide
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5-fluoro-N-(6-hydroxyhexyl)-2-methylbenzamide
CID 103919616

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-hydroxy-N-(8-oxononyl)benzamide?
The IUPAC name of 5-fluoro-2-hydroxy-N-(8-oxononyl)benzamide (CID 59140674) is 5-fluoro-2-hydroxy-N-(8-oxononyl)benzamide.
What is the SMILES notation for 5-fluoro-2-hydroxy-N-(8-oxononyl)benzamide?
The canonical SMILES for 5-fluoro-2-hydroxy-N-(8-oxononyl)benzamide is CC(=O)CCCCCCCNC(=O)c1cc(F)ccc1O.
What is the InChIKey of 5-fluoro-2-hydroxy-N-(8-oxononyl)benzamide?
The InChIKey is QEDQBJNDGKHQIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22FNO3/c1-12(19)7-5-3-2-4-6-10-18-16(21)14-11-13(17)8-9-15(14)20/h8-9,11,20H,2-7,10H2,1H3,(H,18,21).
What are the key properties of 5-fluoro-2-hydroxy-N-(8-oxononyl)benzamide?
5-fluoro-2-hydroxy-N-(8-oxononyl)benzamide has a molecular weight of 295.35 g/mol, XLogP of 3.19, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-hydroxy-N-(8-oxononyl)benzamide is sourced from PubChem (CID 59140674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).