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

C14H20FNO4 — CID 104929735

IUPAC2-fluoro-4-hydroxy-N-[4-(2-methoxyethoxy)butyl]benzamide
SMILESCOCCOCCCCNC(=O)c1ccc(O)cc1F
InChIInChI=1S/C14H20FNO4/c1-19-8-9-20-7-3-2-6-16-14(18)12-5-4-11(17)10-13(12)15/h4-5,10,17H,2-3,6-9H2,1H3,(H,16,18)
InChIKeyCJINVQMNWWHQRQ-UHFFFAOYSA-N
MW285.31 g/mol
LogP1.70
Rot. Bonds9

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

2-fluoro-4-hydroxy-N-[4-(2-methoxyethoxy)butyl]benzamide (PubChem CID 104929735) has the molecular formula C14H20FNO4 and a molecular weight of 285.31 g/mol. Its IUPAC name is 2-fluoro-4-hydroxy-N-[4-(2-methoxyethoxy)butyl]benzamide.

Molecular Properties

Compound Name2-fluoro-4-hydroxy-N-[4-(2-methoxyethoxy)butyl]benzamide
PubChem CID104929735
Molecular FormulaC14H20FNO4
Molecular Weight285.31 g/mol
Exact Mass285.14
IUPAC Name2-fluoro-4-hydroxy-N-[4-(2-methoxyethoxy)butyl]benzamide
SMILESCOCCOCCCCNC(=O)c1ccc(O)cc1F
InChIInChI=1S/C14H20FNO4/c1-19-8-9-20-7-3-2-6-16-14(18)12-5-4-11(17)10-13(12)15/h4-5,10,17H,2-3,6-9H2,1H3,(H,16,18)
InChIKeyCJINVQMNWWHQRQ-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'}

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

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[3-(2-chloroethoxy)propyl]-2-fluoro-4-hydroxybenzamide
CID 114171329
2-fluoro-4-hydroxy-N-[3-(2-methylpropoxy)propyl]benzamide
CID 103940009
4-fluoro-2-hydroxy-N-[4-(2-methoxyethoxy)butyl]benzamide
CID 103829912
2-fluoro-4-hydroxy-N-[2-(2-methoxyethylamino)-2-oxoethyl]benzamide
CID 103941343
N-(6-bromohexyl)-2-fluoro-4-hydroxybenzamide
CID 107847909
2-hydroxy-4-methoxy-N-[3-(2-methoxyethoxy)propyl]benzamide
CID 103604676
4-bromo-2-fluoro-N-(3-methoxypropyl)benzamide
CID 43090254
2-bromo-4-fluoro-N-[3-(2-methoxyethoxy)propyl]benzamide
CID 60668712
2-fluoro-4-methyl-N-(3-propoxypropyl)benzamide
CID 82941071
N-(3-cyclopentylpropyl)-2-fluoro-4-hydroxybenzamide
CID 103940047
2,3-dihydroxy-N-[3-(2-methoxyethoxy)propyl]benzamide
CID 104936500
2-chloro-4,5-difluoro-N-[3-(2-methoxyethoxy)propyl]benzamide
CID 134029639

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-4-hydroxy-N-[4-(2-methoxyethoxy)butyl]benzamide?
The IUPAC name of 2-fluoro-4-hydroxy-N-[4-(2-methoxyethoxy)butyl]benzamide (CID 104929735) is 2-fluoro-4-hydroxy-N-[4-(2-methoxyethoxy)butyl]benzamide.
What is the SMILES notation for 2-fluoro-4-hydroxy-N-[4-(2-methoxyethoxy)butyl]benzamide?
The canonical SMILES for 2-fluoro-4-hydroxy-N-[4-(2-methoxyethoxy)butyl]benzamide is COCCOCCCCNC(=O)c1ccc(O)cc1F.
What is the InChIKey of 2-fluoro-4-hydroxy-N-[4-(2-methoxyethoxy)butyl]benzamide?
The InChIKey is CJINVQMNWWHQRQ-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(17)10-13(12)15/h4-5,10,17H,2-3,6-9H2,1H3,(H,16,18).
What are the key properties of 2-fluoro-4-hydroxy-N-[4-(2-methoxyethoxy)butyl]benzamide?
2-fluoro-4-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 2-fluoro-4-hydroxy-N-[4-(2-methoxyethoxy)butyl]benzamide is sourced from PubChem (CID 104929735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).