2-(2,5-dichlorophenoxy)-5-fluoro-N-methyl-N-phenylbenzamide

C20H14Cl2FNO2 — CID 46195275

IUPAC2-(2,5-dichlorophenoxy)-5-fluoro-N-methyl-N-phenylbenzamide
SMILESCN(C(=O)c1cc(F)ccc1Oc1cc(Cl)ccc1Cl)c1ccccc1
InChIInChI=1S/C20H14Cl2FNO2/c1-24(15-5-3-2-4-6-15)20(25)16-12-14(23)8-10-18(16)26-19-11-13(21)7-9-17(19)22/h2-12H,1H3
InChIKeyGDXWUFAHQRNCLJ-UHFFFAOYSA-N
MW390.24 g/mol
LogP6.20
Rot. Bonds4

About 2-(2,5-dichlorophenoxy)-5-fluoro-N-methyl-N-phenylbenzamide

2-(2,5-dichlorophenoxy)-5-fluoro-N-methyl-N-phenylbenzamide (PubChem CID 46195275) has the molecular formula C20H14Cl2FNO2 and a molecular weight of 390.24 g/mol. Its IUPAC name is 2-(2,5-dichlorophenoxy)-5-fluoro-N-methyl-N-phenylbenzamide.

Molecular Properties

Compound Name2-(2,5-dichlorophenoxy)-5-fluoro-N-methyl-N-phenylbenzamide
PubChem CID46195275
Molecular FormulaC20H14Cl2FNO2
Molecular Weight390.24 g/mol
Exact Mass389.04
IUPAC Name2-(2,5-dichlorophenoxy)-5-fluoro-N-methyl-N-phenylbenzamide
SMILESCN(C(=O)c1cc(F)ccc1Oc1cc(Cl)ccc1Cl)c1ccccc1
InChIInChI=1S/C20H14Cl2FNO2/c1-24(15-5-3-2-4-6-15)20(25)16-12-14(23)8-10-18(16)26-19-11-13(21)7-9-17(19)22/h2-12H,1H3
InChIKeyGDXWUFAHQRNCLJ-UHFFFAOYSA-N
XLogP6.20
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500390.24
LogP ≤ 56.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dichlorophenoxy)-5-fluoro-N-methyl-N-phenylbenzamide?
The IUPAC name of 2-(2,5-dichlorophenoxy)-5-fluoro-N-methyl-N-phenylbenzamide (CID 46195275) is 2-(2,5-dichlorophenoxy)-5-fluoro-N-methyl-N-phenylbenzamide.
What is the SMILES notation for 2-(2,5-dichlorophenoxy)-5-fluoro-N-methyl-N-phenylbenzamide?
The canonical SMILES for 2-(2,5-dichlorophenoxy)-5-fluoro-N-methyl-N-phenylbenzamide is CN(C(=O)c1cc(F)ccc1Oc1cc(Cl)ccc1Cl)c1ccccc1.
What is the InChIKey of 2-(2,5-dichlorophenoxy)-5-fluoro-N-methyl-N-phenylbenzamide?
The InChIKey is GDXWUFAHQRNCLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14Cl2FNO2/c1-24(15-5-3-2-4-6-15)20(25)16-12-14(23)8-10-18(16)26-19-11-13(21)7-9-17(19)22/h2-12H,1H3.
What are the key properties of 2-(2,5-dichlorophenoxy)-5-fluoro-N-methyl-N-phenylbenzamide?
2-(2,5-dichlorophenoxy)-5-fluoro-N-methyl-N-phenylbenzamide has a molecular weight of 390.24 g/mol, XLogP of 6.20, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dichlorophenoxy)-5-fluoro-N-methyl-N-phenylbenzamide is sourced from PubChem (CID 46195275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).