2-[3-(4-fluorophenoxy)-2-methyl-4-oxochromen-7-yl]oxy-N-(2-fluorophenyl)acetamide

C24H17F2NO5 — CID 2405473

IUPAC2-[3-(4-fluorophenoxy)-2-methyl-4-oxochromen-7-yl]oxy-N-(2-fluorophenyl)acetamide
SMILESCc1oc2cc(OCC(=O)Nc3ccccc3F)ccc2c(=O)c1Oc1ccc(F)cc1
InChIInChI=1S/C24H17F2NO5/c1-14-24(32-16-8-6-15(25)7-9-16)23(29)18-11-10-17(12-21(18)31-14)30-13-22(28)27-20-5-3-2-4-19(20)26/h2-12H,13H2,1H3,(H,27,28)
InChIKeyVVZIJURSJOQMML-UHFFFAOYSA-N
MW437.40 g/mol
LogP5.19
Rot. Bonds6

About 2-[3-(4-fluorophenoxy)-2-methyl-4-oxochromen-7-yl]oxy-N-(2-fluorophenyl)acetamide

2-[3-(4-fluorophenoxy)-2-methyl-4-oxochromen-7-yl]oxy-N-(2-fluorophenyl)acetamide (PubChem CID 2405473) has the molecular formula C24H17F2NO5 and a molecular weight of 437.40 g/mol. Its IUPAC name is 2-[3-(4-fluorophenoxy)-2-methyl-4-oxochromen-7-yl]oxy-N-(2-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-[3-(4-fluorophenoxy)-2-methyl-4-oxochromen-7-yl]oxy-N-(2-fluorophenyl)acetamide
PubChem CID2405473
Molecular FormulaC24H17F2NO5
Molecular Weight437.40 g/mol
Exact Mass437.11
IUPAC Name2-[3-(4-fluorophenoxy)-2-methyl-4-oxochromen-7-yl]oxy-N-(2-fluorophenyl)acetamide
SMILESCc1oc2cc(OCC(=O)Nc3ccccc3F)ccc2c(=O)c1Oc1ccc(F)cc1
InChIInChI=1S/C24H17F2NO5/c1-14-24(32-16-8-6-15(25)7-9-16)23(29)18-11-10-17(12-21(18)31-14)30-13-22(28)27-20-5-3-2-4-19(20)26/h2-12H,13H2,1H3,(H,27,28)
InChIKeyVVZIJURSJOQMML-UHFFFAOYSA-N
XLogP5.19
TPSA77.77 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500437.40
LogP ≤ 55.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-[3-(4-fluorophenoxy)-2-methyl-4-oxochromen-7-yl]oxy-N-(2-fluorophenyl)acetamide 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-(2-fluorophenyl)-2-(4-methyl-2-oxochromen-7-yl)oxyacetamide
CID 863920
N-(2,4-dimethylphenyl)-2-[2-methyl-4-oxo-3-(4-propan-2-ylphenoxy)chromen-7-yl]oxyacetamide
CID 2345718
N-[(2R)-2-hydroxypropyl]-2-(2-methyl-4-oxo-3-phenoxychromen-7-yl)oxyacetamide
CID 41111264
2-(2-methyl-4-oxo-3-phenylchromen-7-yl)oxy-N-(2-propoxyphenyl)acetamide
CID 24581989
2-(2-methyl-4-oxo-3-phenylchromen-7-yl)oxy-N-phenylacetamide
CID 7714067
2-[[2-(2-methyl-4-oxo-3-phenoxychromen-7-yl)oxyacetyl]amino]-4-methylsulfanylbutanoic acid
CID 45371003
(2R)-2-[[2-(2-methyl-4-oxo-3-phenoxychromen-7-yl)oxyacetyl]amino]-4-methylsulfanylbutanoic acid
CID 51819684
4-[7-(carboxymethoxy)-2-methyl-4-oxochromen-3-yl]oxybenzoic acid
CID 2322568
N-(2-fluorophenyl)-2-(3-methylphenoxy)acetamide
CID 723312
N-(2,6-dimethylphenyl)-2-(2-methyl-4-oxo-3-phenylchromen-7-yl)oxyacetamide
CID 7714060
2-[3-(2-chloro-6-fluorophenyl)-2-methyl-4-oxochromen-7-yl]oxy-N-propylacetamide
CID 7613115
N-(2-ethoxyphenyl)-2-(4-methyl-2-oxochromen-7-yl)oxyacetamide
CID 7935078

Frequently Asked Questions

What is the IUPAC name of 2-[3-(4-fluorophenoxy)-2-methyl-4-oxochromen-7-yl]oxy-N-(2-fluorophenyl)acetamide?
The IUPAC name of 2-[3-(4-fluorophenoxy)-2-methyl-4-oxochromen-7-yl]oxy-N-(2-fluorophenyl)acetamide (CID 2405473) is 2-[3-(4-fluorophenoxy)-2-methyl-4-oxochromen-7-yl]oxy-N-(2-fluorophenyl)acetamide.
What is the SMILES notation for 2-[3-(4-fluorophenoxy)-2-methyl-4-oxochromen-7-yl]oxy-N-(2-fluorophenyl)acetamide?
The canonical SMILES for 2-[3-(4-fluorophenoxy)-2-methyl-4-oxochromen-7-yl]oxy-N-(2-fluorophenyl)acetamide is Cc1oc2cc(OCC(=O)Nc3ccccc3F)ccc2c(=O)c1Oc1ccc(F)cc1.
What is the InChIKey of 2-[3-(4-fluorophenoxy)-2-methyl-4-oxochromen-7-yl]oxy-N-(2-fluorophenyl)acetamide?
The InChIKey is VVZIJURSJOQMML-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H17F2NO5/c1-14-24(32-16-8-6-15(25)7-9-16)23(29)18-11-10-17(12-21(18)31-14)30-13-22(28)27-20-5-3-2-4-19(20)26/h2-12H,13H2,1H3,(H,27,28).
What are the key properties of 2-[3-(4-fluorophenoxy)-2-methyl-4-oxochromen-7-yl]oxy-N-(2-fluorophenyl)acetamide?
2-[3-(4-fluorophenoxy)-2-methyl-4-oxochromen-7-yl]oxy-N-(2-fluorophenyl)acetamide has a molecular weight of 437.40 g/mol, XLogP of 5.19, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(4-fluorophenoxy)-2-methyl-4-oxochromen-7-yl]oxy-N-(2-fluorophenyl)acetamide is sourced from PubChem (CID 2405473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).