N-(4-fluorophenyl)-2-[(2-formyl-6-methyl-3-pyridinyl)oxy]acetamide

C15H13FN2O3 — CID 78929091

IUPACN-(4-fluorophenyl)-2-[(2-formyl-6-methyl-3-pyridinyl)oxy]acetamide
SMILESCc1ccc(OCC(=O)Nc2ccc(F)cc2)c(C=O)n1
InChIInChI=1S/C15H13FN2O3/c1-10-2-7-14(13(8-19)17-10)21-9-15(20)18-12-5-3-11(16)4-6-12/h2-8H,9H2,1H3,(H,18,20)
InChIKeyLDSCUFMDSPJTBB-UHFFFAOYSA-N
MW288.28 g/mol
LogP2.36
Rot. Bonds5

About N-(4-fluorophenyl)-2-[(2-formyl-6-methyl-3-pyridinyl)oxy]acetamide

N-(4-fluorophenyl)-2-[(2-formyl-6-methyl-3-pyridinyl)oxy]acetamide (PubChem CID 78929091) has the molecular formula C15H13FN2O3 and a molecular weight of 288.28 g/mol. Its IUPAC name is N-(4-fluorophenyl)-2-[(2-formyl-6-methyl-3-pyridinyl)oxy]acetamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-2-[(2-formyl-6-methyl-3-pyridinyl)oxy]acetamide
PubChem CID78929091
Molecular FormulaC15H13FN2O3
Molecular Weight288.28 g/mol
Exact Mass288.09
IUPAC NameN-(4-fluorophenyl)-2-[(2-formyl-6-methyl-3-pyridinyl)oxy]acetamide
SMILESCc1ccc(OCC(=O)Nc2ccc(F)cc2)c(C=O)n1
InChIInChI=1S/C15H13FN2O3/c1-10-2-7-14(13(8-19)17-10)21-9-15(20)18-12-5-3-11(16)4-6-12/h2-8H,9H2,1H3,(H,18,20)
InChIKeyLDSCUFMDSPJTBB-UHFFFAOYSA-N
XLogP2.36
TPSA68.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.28
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(2-fluorophenyl)-2-[(2-formyl-6-methyl-3-pyridinyl)oxy]acetamide
CID 78929098
2-(2,4-difluorophenoxy)-N-(4-fluorophenyl)acetamide
CID 580280
N-(4-bromophenyl)-2-(4-fluoro-2-formylphenoxy)acetamide
CID 107697645
N-(4-fluorophenyl)-2-(4-formyl-2,6-dimethoxyphenoxy)acetamide
CID 28913369
3-ethoxy-4-[2-(4-fluoroanilino)-2-oxoethoxy]benzoic acid
CID 3976698
2-[2-(aminomethyl)-4-methylphenoxy]-N-(4-fluorophenyl)acetamide
CID 63322519
2-(2-methylquinolin-8-yl)oxy-N-(4-methylsulfanylphenyl)acetamide
CID 24581925
2-(2-chloro-4-fluorophenoxy)-N-(4-methylphenyl)acetamide
CID 9402450
2-(5-bromo-2-methylphenoxy)-N-(4-fluorophenyl)acetamide
CID 107284225
N-(4-fluorophenyl)-2-(2-iodophenoxy)acetamide
CID 38878179
2-(2-aminophenoxy)-N-(4-fluorophenyl)acetamide
CID 16789642
2-(2,6-dimethylphenoxy)-N-(4-fluorophenyl)acetamide
CID 776559

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-2-[(2-formyl-6-methyl-3-pyridinyl)oxy]acetamide?
The IUPAC name of N-(4-fluorophenyl)-2-[(2-formyl-6-methyl-3-pyridinyl)oxy]acetamide (CID 78929091) is N-(4-fluorophenyl)-2-[(2-formyl-6-methyl-3-pyridinyl)oxy]acetamide.
What is the SMILES notation for N-(4-fluorophenyl)-2-[(2-formyl-6-methyl-3-pyridinyl)oxy]acetamide?
The canonical SMILES for N-(4-fluorophenyl)-2-[(2-formyl-6-methyl-3-pyridinyl)oxy]acetamide is Cc1ccc(OCC(=O)Nc2ccc(F)cc2)c(C=O)n1.
What is the InChIKey of N-(4-fluorophenyl)-2-[(2-formyl-6-methyl-3-pyridinyl)oxy]acetamide?
The InChIKey is LDSCUFMDSPJTBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13FN2O3/c1-10-2-7-14(13(8-19)17-10)21-9-15(20)18-12-5-3-11(16)4-6-12/h2-8H,9H2,1H3,(H,18,20).
What are the key properties of N-(4-fluorophenyl)-2-[(2-formyl-6-methyl-3-pyridinyl)oxy]acetamide?
N-(4-fluorophenyl)-2-[(2-formyl-6-methyl-3-pyridinyl)oxy]acetamide has a molecular weight of 288.28 g/mol, XLogP of 2.36, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-2-[(2-formyl-6-methyl-3-pyridinyl)oxy]acetamide is sourced from PubChem (CID 78929091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).