2-(2-chloro-4-fluorophenoxy)-N-(4-methylphenyl)acetamide

C15H13ClFNO2 — CID 9402450

IUPAC2-(2-chloro-4-fluorophenoxy)-N-(4-methylphenyl)acetamide
SMILESCc1ccc(NC(=O)COc2ccc(F)cc2Cl)cc1
InChIInChI=1S/C15H13ClFNO2/c1-10-2-5-12(6-3-10)18-15(19)9-20-14-7-4-11(17)8-13(14)16/h2-8H,9H2,1H3,(H,18,19)
InChIKeyIBLIEGXFPNQRJM-UHFFFAOYSA-N
MW293.73 g/mol
LogP3.81
Rot. Bonds4

About 2-(2-chloro-4-fluorophenoxy)-N-(4-methylphenyl)acetamide

2-(2-chloro-4-fluorophenoxy)-N-(4-methylphenyl)acetamide (PubChem CID 9402450) has the molecular formula C15H13ClFNO2 and a molecular weight of 293.73 g/mol. Its IUPAC name is 2-(2-chloro-4-fluorophenoxy)-N-(4-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(2-chloro-4-fluorophenoxy)-N-(4-methylphenyl)acetamide
PubChem CID9402450
Molecular FormulaC15H13ClFNO2
Molecular Weight293.73 g/mol
Exact Mass293.06
IUPAC Name2-(2-chloro-4-fluorophenoxy)-N-(4-methylphenyl)acetamide
SMILESCc1ccc(NC(=O)COc2ccc(F)cc2Cl)cc1
InChIInChI=1S/C15H13ClFNO2/c1-10-2-5-12(6-3-10)18-15(19)9-20-14-7-4-11(17)8-13(14)16/h2-8H,9H2,1H3,(H,18,19)
InChIKeyIBLIEGXFPNQRJM-UHFFFAOYSA-N
XLogP3.81
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.73
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-chloro-4-fluorophenoxy)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]acetamide
CID 8534213
N-(3-acetamidophenyl)-2-(2-chloro-4-fluorophenoxy)acetamide
CID 17172943
2-(2-chloro-4-fluorophenoxy)-N-(2-methyl-1,3-dioxoisoindol-5-yl)acetamide
CID 32744375
2-[2-chloro-4-[(4-ethylanilino)methyl]phenoxy]-N-(4-fluorophenyl)acetamide
CID 3999969
[2-(4-methylanilino)-2-oxoethyl] 2-chloro-4-fluorobenzoate
CID 2349809
N-(2-chloro-4-fluorophenyl)-2-(2-methoxy-4-methylphenoxy)acetamide
CID 18165666
2-[[2-(2,4-dichlorophenoxy)acetyl]amino]-N-(4-fluorophenyl)acetamide
CID 2500780
2-(2-chloro-4-fluorophenoxy)-N-(2,5-difluorophenyl)acetamide
CID 30273064
2-(2,3-dichlorophenoxy)-N-(4-methylphenyl)acetamide
CID 2602907
N-(4-acetamidophenyl)-2-(2-chloro-5-methylphenoxy)acetamide
CID 7731856
2-[4-(anilinomethyl)-2-chlorophenoxy]-N-(4-methylphenyl)acetamide
CID 4593347
N-(1,3-benzodioxol-5-yl)-2-(2-chloro-4-fluorophenoxy)acetamide
CID 7916017

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-4-fluorophenoxy)-N-(4-methylphenyl)acetamide?
The IUPAC name of 2-(2-chloro-4-fluorophenoxy)-N-(4-methylphenyl)acetamide (CID 9402450) is 2-(2-chloro-4-fluorophenoxy)-N-(4-methylphenyl)acetamide.
What is the SMILES notation for 2-(2-chloro-4-fluorophenoxy)-N-(4-methylphenyl)acetamide?
The canonical SMILES for 2-(2-chloro-4-fluorophenoxy)-N-(4-methylphenyl)acetamide is Cc1ccc(NC(=O)COc2ccc(F)cc2Cl)cc1.
What is the InChIKey of 2-(2-chloro-4-fluorophenoxy)-N-(4-methylphenyl)acetamide?
The InChIKey is IBLIEGXFPNQRJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClFNO2/c1-10-2-5-12(6-3-10)18-15(19)9-20-14-7-4-11(17)8-13(14)16/h2-8H,9H2,1H3,(H,18,19).
What are the key properties of 2-(2-chloro-4-fluorophenoxy)-N-(4-methylphenyl)acetamide?
2-(2-chloro-4-fluorophenoxy)-N-(4-methylphenyl)acetamide has a molecular weight of 293.73 g/mol, XLogP of 3.81, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-4-fluorophenoxy)-N-(4-methylphenyl)acetamide is sourced from PubChem (CID 9402450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).