5-fluoro-2-hydroxy-N-(4-methoxybutyl)benzamide

C12H16FNO3 — CID 79523733

IUPAC5-fluoro-2-hydroxy-N-(4-methoxybutyl)benzamide
SMILESCOCCCCNC(=O)c1cc(F)ccc1O
InChIInChI=1S/C12H16FNO3/c1-17-7-3-2-6-14-12(16)10-8-9(13)4-5-11(10)15/h4-5,8,15H,2-3,6-7H2,1H3,(H,14,16)
InChIKeyUDFQDHSFOWCQND-UHFFFAOYSA-N
MW241.26 g/mol
LogP1.69
Rot. Bonds6

About 5-fluoro-2-hydroxy-N-(4-methoxybutyl)benzamide

5-fluoro-2-hydroxy-N-(4-methoxybutyl)benzamide (PubChem CID 79523733) has the molecular formula C12H16FNO3 and a molecular weight of 241.26 g/mol. Its IUPAC name is 5-fluoro-2-hydroxy-N-(4-methoxybutyl)benzamide.

Molecular Properties

Compound Name5-fluoro-2-hydroxy-N-(4-methoxybutyl)benzamide
PubChem CID79523733
Molecular FormulaC12H16FNO3
Molecular Weight241.26 g/mol
Exact Mass241.11
IUPAC Name5-fluoro-2-hydroxy-N-(4-methoxybutyl)benzamide
SMILESCOCCCCNC(=O)c1cc(F)ccc1O
InChIInChI=1S/C12H16FNO3/c1-17-7-3-2-6-14-12(16)10-8-9(13)4-5-11(10)15/h4-5,8,15H,2-3,6-7H2,1H3,(H,14,16)
InChIKeyUDFQDHSFOWCQND-UHFFFAOYSA-N
XLogP1.69
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.26
LogP ≤ 51.69
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

5-fluoro-2-hydroxy-N-(4-hydroxybutyl)benzamide
CID 106843460
4-fluoro-2-hydroxy-N-[4-(2-methoxyethoxy)butyl]benzamide
CID 103829912
5-fluoro-2-hydroxy-N-(8-oxononyl)benzamide
CID 59140674
5-fluoro-2-hydroxy-N-(2-hydroxyethyl)benzamide
CID 67742481
N-ethyl-5-fluoro-2-hydroxybenzamide
CID 79531934
2-bromo-5-fluoro-N-(2-methoxyethyl)benzamide
CID 24703783
N-[2-(2-bromoethoxy)ethyl]-5-fluoro-2-hydroxybenzamide
CID 115299614
5-fluoro-2-hydroxy-N-[3-(methylamino)-3-oxopropyl]benzamide
CID 79881248
5-fluoro-2-hydroxy-N-(2-phenoxyethyl)benzamide
CID 79532175
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-[(5-fluoro-2-hydroxybenzoyl)amino]-2-methylbutanoic acid
CID 115298591
2-fluoro-N-(5-methoxypentyl)-3-methylbenzamide
CID 103764860

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-hydroxy-N-(4-methoxybutyl)benzamide?
The IUPAC name of 5-fluoro-2-hydroxy-N-(4-methoxybutyl)benzamide (CID 79523733) is 5-fluoro-2-hydroxy-N-(4-methoxybutyl)benzamide.
What is the SMILES notation for 5-fluoro-2-hydroxy-N-(4-methoxybutyl)benzamide?
The canonical SMILES for 5-fluoro-2-hydroxy-N-(4-methoxybutyl)benzamide is COCCCCNC(=O)c1cc(F)ccc1O.
What is the InChIKey of 5-fluoro-2-hydroxy-N-(4-methoxybutyl)benzamide?
The InChIKey is UDFQDHSFOWCQND-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16FNO3/c1-17-7-3-2-6-14-12(16)10-8-9(13)4-5-11(10)15/h4-5,8,15H,2-3,6-7H2,1H3,(H,14,16).
What are the key properties of 5-fluoro-2-hydroxy-N-(4-methoxybutyl)benzamide?
5-fluoro-2-hydroxy-N-(4-methoxybutyl)benzamide has a molecular weight of 241.26 g/mol, XLogP of 1.69, 6 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-(4-methoxybutyl)benzamide is sourced from PubChem (CID 79523733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).