2-[2-(2,6-dichloroanilino)phenyl]-N-(2-ethoxyethyl)acetamide

C18H20Cl2N2O2 — CID 126576343

IUPAC2-[2-(2,6-dichloroanilino)phenyl]-N-(2-ethoxyethyl)acetamide
SMILESCCOCCNC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl
InChIInChI=1S/C18H20Cl2N2O2/c1-2-24-11-10-21-17(23)12-13-6-3-4-9-16(13)22-18-14(19)7-5-8-15(18)20/h3-9,22H,2,10-12H2,1H3,(H,21,23)
InChIKeyGTXSSOAMWGLBHU-UHFFFAOYSA-N
MW367.28 g/mol
LogP4.43
Rot. Bonds8

About 2-[2-(2,6-dichloroanilino)phenyl]-N-(2-ethoxyethyl)acetamide

2-[2-(2,6-dichloroanilino)phenyl]-N-(2-ethoxyethyl)acetamide (PubChem CID 126576343) has the molecular formula C18H20Cl2N2O2 and a molecular weight of 367.28 g/mol. Its IUPAC name is 2-[2-(2,6-dichloroanilino)phenyl]-N-(2-ethoxyethyl)acetamide.

Molecular Properties

Compound Name2-[2-(2,6-dichloroanilino)phenyl]-N-(2-ethoxyethyl)acetamide
PubChem CID126576343
Molecular FormulaC18H20Cl2N2O2
Molecular Weight367.28 g/mol
Exact Mass366.09
IUPAC Name2-[2-(2,6-dichloroanilino)phenyl]-N-(2-ethoxyethyl)acetamide
SMILESCCOCCNC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl
InChIInChI=1S/C18H20Cl2N2O2/c1-2-24-11-10-21-17(23)12-13-6-3-4-9-16(13)22-18-14(19)7-5-8-15(18)20/h3-9,22H,2,10-12H2,1H3,(H,21,23)
InChIKeyGTXSSOAMWGLBHU-UHFFFAOYSA-N
XLogP4.43
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.28
LogP ≤ 54.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[2-[2-[2-(2,6-dichloroanilino)phenyl]acetyl]oxyethoxy]ethyl 2-[2-(2,6-dichloroanilino)phenyl]acetate
CID 59981465
2-[2-(2,6-dichloroanilino)phenyl]acetic acid;hydrate
CID 68653725
pentyl 2-[2-(2,6-dichloroanilino)phenyl]acetate
CID 59514929
2-[2-(2,6-dichloroanilino)phenyl]-N-(4-propan-2-yloxyphenyl)acetamide
CID 54789933
2-butoxyethyl 2-[2-(2,6-dichloroanilino)phenyl]acetate
CID 159842705
strontium;2-[2-(2,6-dichloroanilino)phenyl]acetic acid;hydride
CID 173032882
[2-(2-methoxyethoxymethoxy)-2-oxoethyl] 2-[2-(2,6-dichloroanilino)phenyl]acetate
CID 142648888
N-(4-chlorophenyl)-2-[2-(2,6-dichloroanilino)phenyl]acetamide
CID 23764468
2-[2-(2,6-dichloroanilino)phenyl]-N-[(2S)-4-methyl-1-oxopentan-2-yl]acetamide
CID 22824884
(2-methoxy-2-oxoethyl) 2-[2-(2,6-dichloroanilino)phenyl]acetate
CID 46783545
CID 174078245
CID 174078245
2-(2-aminoethoxy)ethyl 2-[2-(2,6-dichloroanilino)phenyl]acetate;hydrochloride
CID 25230838

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2,6-dichloroanilino)phenyl]-N-(2-ethoxyethyl)acetamide?
The IUPAC name of 2-[2-(2,6-dichloroanilino)phenyl]-N-(2-ethoxyethyl)acetamide (CID 126576343) is 2-[2-(2,6-dichloroanilino)phenyl]-N-(2-ethoxyethyl)acetamide.
What is the SMILES notation for 2-[2-(2,6-dichloroanilino)phenyl]-N-(2-ethoxyethyl)acetamide?
The canonical SMILES for 2-[2-(2,6-dichloroanilino)phenyl]-N-(2-ethoxyethyl)acetamide is CCOCCNC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl.
What is the InChIKey of 2-[2-(2,6-dichloroanilino)phenyl]-N-(2-ethoxyethyl)acetamide?
The InChIKey is GTXSSOAMWGLBHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20Cl2N2O2/c1-2-24-11-10-21-17(23)12-13-6-3-4-9-16(13)22-18-14(19)7-5-8-15(18)20/h3-9,22H,2,10-12H2,1H3,(H,21,23).
What are the key properties of 2-[2-(2,6-dichloroanilino)phenyl]-N-(2-ethoxyethyl)acetamide?
2-[2-(2,6-dichloroanilino)phenyl]-N-(2-ethoxyethyl)acetamide has a molecular weight of 367.28 g/mol, XLogP of 4.43, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2,6-dichloroanilino)phenyl]-N-(2-ethoxyethyl)acetamide is sourced from PubChem (CID 126576343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).