N-(3-acetamidophenyl)-2-(2-chloro-4-fluorophenoxy)acetamide

C16H14ClFN2O3 — CID 17172943

IUPACN-(3-acetamidophenyl)-2-(2-chloro-4-fluorophenoxy)acetamide
SMILESCC(=O)Nc1cccc(NC(=O)COc2ccc(F)cc2Cl)c1
InChIInChI=1S/C16H14ClFN2O3/c1-10(21)19-12-3-2-4-13(8-12)20-16(22)9-23-15-6-5-11(18)7-14(15)17/h2-8H,9H2,1H3,(H,19,21)(H,20,22)
InChIKeyJPRADZGLTYLKCE-UHFFFAOYSA-N
MW336.75 g/mol
LogP3.45
Rot. Bonds5

About N-(3-acetamidophenyl)-2-(2-chloro-4-fluorophenoxy)acetamide

N-(3-acetamidophenyl)-2-(2-chloro-4-fluorophenoxy)acetamide (PubChem CID 17172943) has the molecular formula C16H14ClFN2O3 and a molecular weight of 336.75 g/mol. Its IUPAC name is N-(3-acetamidophenyl)-2-(2-chloro-4-fluorophenoxy)acetamide.

Molecular Properties

Compound NameN-(3-acetamidophenyl)-2-(2-chloro-4-fluorophenoxy)acetamide
PubChem CID17172943
Molecular FormulaC16H14ClFN2O3
Molecular Weight336.75 g/mol
Exact Mass336.07
IUPAC NameN-(3-acetamidophenyl)-2-(2-chloro-4-fluorophenoxy)acetamide
SMILESCC(=O)Nc1cccc(NC(=O)COc2ccc(F)cc2Cl)c1
InChIInChI=1S/C16H14ClFN2O3/c1-10(21)19-12-3-2-4-13(8-12)20-16(22)9-23-15-6-5-11(18)7-14(15)17/h2-8H,9H2,1H3,(H,19,21)(H,20,22)
InChIKeyJPRADZGLTYLKCE-UHFFFAOYSA-N
XLogP3.45
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.75
LogP ≤ 53.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-chloro-4-fluorophenoxy)-N-(4-methylphenyl)acetamide
CID 9402450
N-(3-chlorophenyl)-2-(2,4-difluorophenoxy)acetamide
CID 17173171
N-[3-[[2-(2-chlorophenoxy)acetyl]amino]phenyl]propanamide
CID 17027266
N-(4-acetamidophenyl)-2-(2,4-dichlorophenoxy)acetamide
CID 1039828
2-(2-chloro-4-fluorophenoxy)-N-(2-methyl-1,3-dioxoisoindol-5-yl)acetamide
CID 32744375
N-[3-[[2-(2,4-dichlorophenoxy)acetyl]amino]phenyl]butanamide
CID 1361275
2-(2-chloro-4-fluorophenoxy)-N-(2,5-difluorophenyl)acetamide
CID 30273064
N-(1,3-benzodioxol-5-yl)-2-(2-chloro-4-fluorophenoxy)acetamide
CID 7916017
2-(2-chloro-4-fluorophenoxy)-N'-[2-(2,6-dimethylphenoxy)acetyl]acetohydrazide
CID 9428415
2-(2-chloro-4-methylphenoxy)-N-(3-chlorophenyl)acetamide
CID 161150821
2-(2-chloro-4-fluorophenoxy)acetohydrazide
CID 3818760
N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]acetamide
CID 33064316

Frequently Asked Questions

What is the IUPAC name of N-(3-acetamidophenyl)-2-(2-chloro-4-fluorophenoxy)acetamide?
The IUPAC name of N-(3-acetamidophenyl)-2-(2-chloro-4-fluorophenoxy)acetamide (CID 17172943) is N-(3-acetamidophenyl)-2-(2-chloro-4-fluorophenoxy)acetamide.
What is the SMILES notation for N-(3-acetamidophenyl)-2-(2-chloro-4-fluorophenoxy)acetamide?
The canonical SMILES for N-(3-acetamidophenyl)-2-(2-chloro-4-fluorophenoxy)acetamide is CC(=O)Nc1cccc(NC(=O)COc2ccc(F)cc2Cl)c1.
What is the InChIKey of N-(3-acetamidophenyl)-2-(2-chloro-4-fluorophenoxy)acetamide?
The InChIKey is JPRADZGLTYLKCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14ClFN2O3/c1-10(21)19-12-3-2-4-13(8-12)20-16(22)9-23-15-6-5-11(18)7-14(15)17/h2-8H,9H2,1H3,(H,19,21)(H,20,22).
What are the key properties of N-(3-acetamidophenyl)-2-(2-chloro-4-fluorophenoxy)acetamide?
N-(3-acetamidophenyl)-2-(2-chloro-4-fluorophenoxy)acetamide has a molecular weight of 336.75 g/mol, XLogP of 3.45, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetamidophenyl)-2-(2-chloro-4-fluorophenoxy)acetamide is sourced from PubChem (CID 17172943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).