2-(4-fluorophenoxy)-N-(2-hydroxy-5-methylphenyl)acetamide

C15H14FNO3 — CID 894086

IUPAC2-(4-fluorophenoxy)-N-(2-hydroxy-5-methylphenyl)acetamide
SMILESCc1ccc(O)c(NC(=O)COc2ccc(F)cc2)c1
InChIInChI=1S/C15H14FNO3/c1-10-2-7-14(18)13(8-10)17-15(19)9-20-12-5-3-11(16)4-6-12/h2-8,18H,9H2,1H3,(H,17,19)
InChIKeyWSANPOYMMUQEGR-UHFFFAOYSA-N
MW275.28 g/mol
LogP2.86
Rot. Bonds4

About 2-(4-fluorophenoxy)-N-(2-hydroxy-5-methylphenyl)acetamide

2-(4-fluorophenoxy)-N-(2-hydroxy-5-methylphenyl)acetamide (PubChem CID 894086) has the molecular formula C15H14FNO3 and a molecular weight of 275.28 g/mol. Its IUPAC name is 2-(4-fluorophenoxy)-N-(2-hydroxy-5-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(4-fluorophenoxy)-N-(2-hydroxy-5-methylphenyl)acetamide
PubChem CID894086
Molecular FormulaC15H14FNO3
Molecular Weight275.28 g/mol
Exact Mass275.10
IUPAC Name2-(4-fluorophenoxy)-N-(2-hydroxy-5-methylphenyl)acetamide
SMILESCc1ccc(O)c(NC(=O)COc2ccc(F)cc2)c1
InChIInChI=1S/C15H14FNO3/c1-10-2-7-14(18)13(8-10)17-15(19)9-20-12-5-3-11(16)4-6-12/h2-8,18H,9H2,1H3,(H,17,19)
InChIKeyWSANPOYMMUQEGR-UHFFFAOYSA-N
XLogP2.86
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.28
LogP ≤ 52.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenoxy)-N-(2-hydroxy-5-methylphenyl)acetamide?
The IUPAC name of 2-(4-fluorophenoxy)-N-(2-hydroxy-5-methylphenyl)acetamide (CID 894086) is 2-(4-fluorophenoxy)-N-(2-hydroxy-5-methylphenyl)acetamide.
What is the SMILES notation for 2-(4-fluorophenoxy)-N-(2-hydroxy-5-methylphenyl)acetamide?
The canonical SMILES for 2-(4-fluorophenoxy)-N-(2-hydroxy-5-methylphenyl)acetamide is Cc1ccc(O)c(NC(=O)COc2ccc(F)cc2)c1.
What is the InChIKey of 2-(4-fluorophenoxy)-N-(2-hydroxy-5-methylphenyl)acetamide?
The InChIKey is WSANPOYMMUQEGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FNO3/c1-10-2-7-14(18)13(8-10)17-15(19)9-20-12-5-3-11(16)4-6-12/h2-8,18H,9H2,1H3,(H,17,19).
What are the key properties of 2-(4-fluorophenoxy)-N-(2-hydroxy-5-methylphenyl)acetamide?
2-(4-fluorophenoxy)-N-(2-hydroxy-5-methylphenyl)acetamide has a molecular weight of 275.28 g/mol, XLogP of 2.86, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenoxy)-N-(2-hydroxy-5-methylphenyl)acetamide is sourced from PubChem (CID 894086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).