N-(2,3-dichlorophenyl)-2-(4-propan-2-ylphenoxy)acetamide

C17H17Cl2NO2 — CID 1226590

IUPACN-(2,3-dichlorophenyl)-2-(4-propan-2-ylphenoxy)acetamide
SMILESCC(C)c1ccc(OCC(=O)Nc2cccc(Cl)c2Cl)cc1
InChIInChI=1S/C17H17Cl2NO2/c1-11(2)12-6-8-13(9-7-12)22-10-16(21)20-15-5-3-4-14(18)17(15)19/h3-9,11H,10H2,1-2H3,(H,20,21)
InChIKeyCLDCWJADLLPCPL-UHFFFAOYSA-N
MW338.23 g/mol
LogP5.13
Rot. Bonds5

About N-(2,3-dichlorophenyl)-2-(4-propan-2-ylphenoxy)acetamide

N-(2,3-dichlorophenyl)-2-(4-propan-2-ylphenoxy)acetamide (PubChem CID 1226590) has the molecular formula C17H17Cl2NO2 and a molecular weight of 338.23 g/mol. Its IUPAC name is N-(2,3-dichlorophenyl)-2-(4-propan-2-ylphenoxy)acetamide.

Molecular Properties

Compound NameN-(2,3-dichlorophenyl)-2-(4-propan-2-ylphenoxy)acetamide
PubChem CID1226590
Molecular FormulaC17H17Cl2NO2
Molecular Weight338.23 g/mol
Exact Mass337.06
IUPAC NameN-(2,3-dichlorophenyl)-2-(4-propan-2-ylphenoxy)acetamide
SMILESCC(C)c1ccc(OCC(=O)Nc2cccc(Cl)c2Cl)cc1
InChIInChI=1S/C17H17Cl2NO2/c1-11(2)12-6-8-13(9-7-12)22-10-16(21)20-15-5-3-4-14(18)17(15)19/h3-9,11H,10H2,1-2H3,(H,20,21)
InChIKeyCLDCWJADLLPCPL-UHFFFAOYSA-N
XLogP5.13
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500338.23
LogP ≤ 55.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(2,3-dichlorophenyl)-2-(4-propan-2-ylphenoxy)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-(2,3-dichlorophenyl)-2-(4-iodophenoxy)acetamide
CID 55325965
N-(2,3-dichlorophenyl)-2-[4-(2-ethoxyethoxy)phenoxy]acetamide
CID 4732993
N-(2-chlorophenyl)-4-oxo-4-[2-[2-(4-propan-2-ylphenoxy)acetyl]hydrazinyl]butanamide
CID 4513816
N-(2,3-dichlorophenyl)-2-(4-propan-2-ylphenyl)acetamide
CID 41362554
N-(2,3-dichlorophenyl)-2-[4-[[(1S)-1-phenylethyl]sulfamoyl]phenoxy]acetamide
CID 126152019
N-(2,3-dichlorophenyl)-2-[4-(3,5-dimethylphenoxy)phenoxy]acetamide
CID 18870437
N-(2,3-dichlorophenyl)-2-[4-[methyl(methylsulfonyl)amino]phenoxy]acetamide
CID 30128451
[2-(2,3-dichloroanilino)-2-oxoethyl] 2-methylpropanoate
CID 7782625
N-(2-ethoxyphenyl)-2-(4-propan-2-ylphenoxy)acetamide
CID 723516
N-(2-chloro-4-fluorophenyl)-2-(4-propan-2-ylphenoxy)acetamide
CID 26216318
N-(4-amino-2,5-dichlorophenyl)-2-(4-propan-2-ylphenoxy)acetamide
CID 50881877
N-(4-bromo-2-chlorophenyl)-2-(4-propan-2-ylphenoxy)acetamide
CID 53267518

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dichlorophenyl)-2-(4-propan-2-ylphenoxy)acetamide?
The IUPAC name of N-(2,3-dichlorophenyl)-2-(4-propan-2-ylphenoxy)acetamide (CID 1226590) is N-(2,3-dichlorophenyl)-2-(4-propan-2-ylphenoxy)acetamide.
What is the SMILES notation for N-(2,3-dichlorophenyl)-2-(4-propan-2-ylphenoxy)acetamide?
The canonical SMILES for N-(2,3-dichlorophenyl)-2-(4-propan-2-ylphenoxy)acetamide is CC(C)c1ccc(OCC(=O)Nc2cccc(Cl)c2Cl)cc1.
What is the InChIKey of N-(2,3-dichlorophenyl)-2-(4-propan-2-ylphenoxy)acetamide?
The InChIKey is CLDCWJADLLPCPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17Cl2NO2/c1-11(2)12-6-8-13(9-7-12)22-10-16(21)20-15-5-3-4-14(18)17(15)19/h3-9,11H,10H2,1-2H3,(H,20,21).
What are the key properties of N-(2,3-dichlorophenyl)-2-(4-propan-2-ylphenoxy)acetamide?
N-(2,3-dichlorophenyl)-2-(4-propan-2-ylphenoxy)acetamide has a molecular weight of 338.23 g/mol, XLogP of 5.13, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dichlorophenyl)-2-(4-propan-2-ylphenoxy)acetamide is sourced from PubChem (CID 1226590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).