N-(2,3-dichlorophenyl)-2-[2-(2-ethoxyethoxy)anilino]acetamide

C18H20Cl2N2O3 — CID 54827691

IUPACN-(2,3-dichlorophenyl)-2-[2-(2-ethoxyethoxy)anilino]acetamide
SMILESCCOCCOc1ccccc1NCC(=O)Nc1cccc(Cl)c1Cl
InChIInChI=1S/C18H20Cl2N2O3/c1-2-24-10-11-25-16-9-4-3-7-14(16)21-12-17(23)22-15-8-5-6-13(19)18(15)20/h3-9,21H,2,10-12H2,1H3,(H,22,23)
InChIKeyPIOAEDMEACGTRH-UHFFFAOYSA-N
MW383.28 g/mol
LogP4.46
Rot. Bonds9

About N-(2,3-dichlorophenyl)-2-[2-(2-ethoxyethoxy)anilino]acetamide

N-(2,3-dichlorophenyl)-2-[2-(2-ethoxyethoxy)anilino]acetamide (PubChem CID 54827691) has the molecular formula C18H20Cl2N2O3 and a molecular weight of 383.28 g/mol. Its IUPAC name is N-(2,3-dichlorophenyl)-2-[2-(2-ethoxyethoxy)anilino]acetamide.

Molecular Properties

Compound NameN-(2,3-dichlorophenyl)-2-[2-(2-ethoxyethoxy)anilino]acetamide
PubChem CID54827691
Molecular FormulaC18H20Cl2N2O3
Molecular Weight383.28 g/mol
Exact Mass382.09
IUPAC NameN-(2,3-dichlorophenyl)-2-[2-(2-ethoxyethoxy)anilino]acetamide
SMILESCCOCCOc1ccccc1NCC(=O)Nc1cccc(Cl)c1Cl
InChIInChI=1S/C18H20Cl2N2O3/c1-2-24-10-11-25-16-9-4-3-7-14(16)21-12-17(23)22-15-8-5-6-13(19)18(15)20/h3-9,21H,2,10-12H2,1H3,(H,22,23)
InChIKeyPIOAEDMEACGTRH-UHFFFAOYSA-N
XLogP4.46
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.28
LogP ≤ 54.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(2,3-dichlorophenyl)-2-[2-(2-ethoxyethoxy)anilino]acetamide?
The IUPAC name of N-(2,3-dichlorophenyl)-2-[2-(2-ethoxyethoxy)anilino]acetamide (CID 54827691) is N-(2,3-dichlorophenyl)-2-[2-(2-ethoxyethoxy)anilino]acetamide.
What is the SMILES notation for N-(2,3-dichlorophenyl)-2-[2-(2-ethoxyethoxy)anilino]acetamide?
The canonical SMILES for N-(2,3-dichlorophenyl)-2-[2-(2-ethoxyethoxy)anilino]acetamide is CCOCCOc1ccccc1NCC(=O)Nc1cccc(Cl)c1Cl.
What is the InChIKey of N-(2,3-dichlorophenyl)-2-[2-(2-ethoxyethoxy)anilino]acetamide?
The InChIKey is PIOAEDMEACGTRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20Cl2N2O3/c1-2-24-10-11-25-16-9-4-3-7-14(16)21-12-17(23)22-15-8-5-6-13(19)18(15)20/h3-9,21H,2,10-12H2,1H3,(H,22,23).
What are the key properties of N-(2,3-dichlorophenyl)-2-[2-(2-ethoxyethoxy)anilino]acetamide?
N-(2,3-dichlorophenyl)-2-[2-(2-ethoxyethoxy)anilino]acetamide has a molecular weight of 383.28 g/mol, XLogP of 4.46, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dichlorophenyl)-2-[2-(2-ethoxyethoxy)anilino]acetamide is sourced from PubChem (CID 54827691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).