4-fluoro-2-hydroxy-N-[4-(2-methoxyethoxy)butyl]benzamide

C14H20FNO4 — CID 103829912

IUPAC4-fluoro-2-hydroxy-N-[4-(2-methoxyethoxy)butyl]benzamide
SMILESCOCCOCCCCNC(=O)c1ccc(F)cc1O
InChIInChI=1S/C14H20FNO4/c1-19-8-9-20-7-3-2-6-16-14(18)12-5-4-11(15)10-13(12)17/h4-5,10,17H,2-3,6-9H2,1H3,(H,16,18)
InChIKeyJAOCZWPSMIUNNM-UHFFFAOYSA-N
MW285.31 g/mol
LogP1.70
Rot. Bonds9

About 4-fluoro-2-hydroxy-N-[4-(2-methoxyethoxy)butyl]benzamide

4-fluoro-2-hydroxy-N-[4-(2-methoxyethoxy)butyl]benzamide (PubChem CID 103829912) has the molecular formula C14H20FNO4 and a molecular weight of 285.31 g/mol. Its IUPAC name is 4-fluoro-2-hydroxy-N-[4-(2-methoxyethoxy)butyl]benzamide.

Molecular Properties

Compound Name4-fluoro-2-hydroxy-N-[4-(2-methoxyethoxy)butyl]benzamide
PubChem CID103829912
Molecular FormulaC14H20FNO4
Molecular Weight285.31 g/mol
Exact Mass285.14
IUPAC Name4-fluoro-2-hydroxy-N-[4-(2-methoxyethoxy)butyl]benzamide
SMILESCOCCOCCCCNC(=O)c1ccc(F)cc1O
InChIInChI=1S/C14H20FNO4/c1-19-8-9-20-7-3-2-6-16-14(18)12-5-4-11(15)10-13(12)17/h4-5,10,17H,2-3,6-9H2,1H3,(H,16,18)
InChIKeyJAOCZWPSMIUNNM-UHFFFAOYSA-N
XLogP1.70
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.31
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(3-butoxypropyl)-4-fluoro-2-hydroxybenzamide
CID 103829628
N-(3-ethoxypropyl)-4-fluoro-2-hydroxybenzamide
CID 103829625
N-[3-(2-chloroethoxy)propyl]-4-fluoro-2-hydroxybenzamide
CID 106307111
5-fluoro-2-hydroxy-N-(4-methoxybutyl)benzamide
CID 79523733
2-fluoro-4-hydroxy-N-[4-(2-methoxyethoxy)butyl]benzamide
CID 104929735
2-bromo-4-fluoro-N-[3-(2-methoxyethoxy)propyl]benzamide
CID 60668712
2-hydroxy-4-methoxy-N-[3-(2-methoxyethoxy)propyl]benzamide
CID 103604676
N-(4-aminobutyl)-4-fluoro-2-hydroxybenzamide
CID 107012875
4-fluoro-2-hydroxy-N-(4-methylsulfanylbutyl)benzamide
CID 113304588
4-fluoro-2-hydroxy-N-[3-(2-methylpropanoylamino)propyl]benzamide
CID 86814360
4-fluoro-2-hydroxy-N-(4-methylpentyl)benzamide
CID 103829717
4-[(4-fluoro-2-hydroxybenzoyl)amino]butanoic acid
CID 107013327

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-2-hydroxy-N-[4-(2-methoxyethoxy)butyl]benzamide?
The IUPAC name of 4-fluoro-2-hydroxy-N-[4-(2-methoxyethoxy)butyl]benzamide (CID 103829912) is 4-fluoro-2-hydroxy-N-[4-(2-methoxyethoxy)butyl]benzamide.
What is the SMILES notation for 4-fluoro-2-hydroxy-N-[4-(2-methoxyethoxy)butyl]benzamide?
The canonical SMILES for 4-fluoro-2-hydroxy-N-[4-(2-methoxyethoxy)butyl]benzamide is COCCOCCCCNC(=O)c1ccc(F)cc1O.
What is the InChIKey of 4-fluoro-2-hydroxy-N-[4-(2-methoxyethoxy)butyl]benzamide?
The InChIKey is JAOCZWPSMIUNNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FNO4/c1-19-8-9-20-7-3-2-6-16-14(18)12-5-4-11(15)10-13(12)17/h4-5,10,17H,2-3,6-9H2,1H3,(H,16,18).
What are the key properties of 4-fluoro-2-hydroxy-N-[4-(2-methoxyethoxy)butyl]benzamide?
4-fluoro-2-hydroxy-N-[4-(2-methoxyethoxy)butyl]benzamide has a molecular weight of 285.31 g/mol, XLogP of 1.70, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-2-hydroxy-N-[4-(2-methoxyethoxy)butyl]benzamide is sourced from PubChem (CID 103829912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).