2-(2,4-dichlorophenoxy)-N-[2-[2-[[2-(2,4-dichlorophenoxy)acetyl]amino]phenyl]phenyl]acetamide

C28H20Cl4N2O4 — CID 2198238

IUPAC2-(2,4-dichlorophenoxy)-N-[2-[2-[[2-(2,4-dichlorophenoxy)acetyl]amino]phenyl]phenyl]acetamide
SMILESO=C(COc1ccc(Cl)cc1Cl)Nc1ccccc1-c1ccccc1NC(=O)COc1ccc(Cl)cc1Cl
InChIInChI=1S/C28H20Cl4N2O4/c29-17-9-11-25(21(31)13-17)37-15-27(35)33-23-7-3-1-5-19(23)20-6-2-4-8-24(20)34-28(36)16-38-26-12-10-18(30)14-22(26)32/h1-14H,15-16H2,(H,33,35)(H,34,36)
InChIKeyLJWCWTFQOWNLBD-UHFFFAOYSA-N
MW590.29 g/mol
LogP8.00
Rot. Bonds9

About 2-(2,4-dichlorophenoxy)-N-[2-[2-[[2-(2,4-dichlorophenoxy)acetyl]amino]phenyl]phenyl]acetamide

2-(2,4-dichlorophenoxy)-N-[2-[2-[[2-(2,4-dichlorophenoxy)acetyl]amino]phenyl]phenyl]acetamide (PubChem CID 2198238) has the molecular formula C28H20Cl4N2O4 and a molecular weight of 590.29 g/mol. Its IUPAC name is 2-(2,4-dichlorophenoxy)-N-[2-[2-[[2-(2,4-dichlorophenoxy)acetyl]amino]phenyl]phenyl]acetamide.

Molecular Properties

Compound Name2-(2,4-dichlorophenoxy)-N-[2-[2-[[2-(2,4-dichlorophenoxy)acetyl]amino]phenyl]phenyl]acetamide
PubChem CID2198238
Molecular FormulaC28H20Cl4N2O4
Molecular Weight590.29 g/mol
Exact Mass588.02
IUPAC Name2-(2,4-dichlorophenoxy)-N-[2-[2-[[2-(2,4-dichlorophenoxy)acetyl]amino]phenyl]phenyl]acetamide
SMILESO=C(COc1ccc(Cl)cc1Cl)Nc1ccccc1-c1ccccc1NC(=O)COc1ccc(Cl)cc1Cl
InChIInChI=1S/C28H20Cl4N2O4/c29-17-9-11-25(21(31)13-17)37-15-27(35)33-23-7-3-1-5-19(23)20-6-2-4-8-24(20)34-28(36)16-38-26-12-10-18(30)14-22(26)32/h1-14H,15-16H2,(H,33,35)(H,34,36)
InChIKeyLJWCWTFQOWNLBD-UHFFFAOYSA-N
XLogP8.00
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms38
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500590.29
LogP ≤ 58.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-chlorophenyl)-2-(2,4-dichlorophenoxy)acetamide
CID 744320
2-[2-[[2-(2,4-dichlorophenoxy)acetyl]amino]phenyl]acetic acid
CID 166178801
2-(2,4-dichlorophenoxy)-N-[2-[2-(2-fluorophenyl)-1,3-thiazol-4-yl]phenyl]acetamide
CID 121148599
N-(2-benzoyl-4-chlorophenyl)-2-(2,4-dichlorophenoxy)acetamide
CID 3544695
5-chloro-2-[[2-(2,4-dichlorophenoxy)acetyl]amino]benzamide
CID 122187999
2-(2,4-dichlorophenoxy)-N-[2-(ethoxymethyl)phenyl]acetamide
CID 86821663
N-[2-[acetyl(methyl)amino]phenyl]-2-(2,4-dichlorophenoxy)acetamide
CID 113093774
2-(4-bromo-2-chlorophenoxy)-N-(2-phenylphenyl)acetamide
CID 2234948
2-(2,4-dichlorophenoxy)-N-pyridin-2-ylacetamide
CID 792334
2-(2,4-dichlorophenoxy)-N-(4-hydroxyphenyl)acetamide
CID 976414
2-(2,4-dichlorophenoxy)-N-quinolin-8-ylacetamide
CID 2180532
N-[3-[[2-(2,4-dichlorophenoxy)acetyl]amino]-2-methylphenyl]cyclopropanecarboxamide
CID 46761205

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenoxy)-N-[2-[2-[[2-(2,4-dichlorophenoxy)acetyl]amino]phenyl]phenyl]acetamide?
The IUPAC name of 2-(2,4-dichlorophenoxy)-N-[2-[2-[[2-(2,4-dichlorophenoxy)acetyl]amino]phenyl]phenyl]acetamide (CID 2198238) is 2-(2,4-dichlorophenoxy)-N-[2-[2-[[2-(2,4-dichlorophenoxy)acetyl]amino]phenyl]phenyl]acetamide.
What is the SMILES notation for 2-(2,4-dichlorophenoxy)-N-[2-[2-[[2-(2,4-dichlorophenoxy)acetyl]amino]phenyl]phenyl]acetamide?
The canonical SMILES for 2-(2,4-dichlorophenoxy)-N-[2-[2-[[2-(2,4-dichlorophenoxy)acetyl]amino]phenyl]phenyl]acetamide is O=C(COc1ccc(Cl)cc1Cl)Nc1ccccc1-c1ccccc1NC(=O)COc1ccc(Cl)cc1Cl.
What is the InChIKey of 2-(2,4-dichlorophenoxy)-N-[2-[2-[[2-(2,4-dichlorophenoxy)acetyl]amino]phenyl]phenyl]acetamide?
The InChIKey is LJWCWTFQOWNLBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H20Cl4N2O4/c29-17-9-11-25(21(31)13-17)37-15-27(35)33-23-7-3-1-5-19(23)20-6-2-4-8-24(20)34-28(36)16-38-26-12-10-18(30)14-22(26)32/h1-14H,15-16H2,(H,33,35)(H,34,36).
What are the key properties of 2-(2,4-dichlorophenoxy)-N-[2-[2-[[2-(2,4-dichlorophenoxy)acetyl]amino]phenyl]phenyl]acetamide?
2-(2,4-dichlorophenoxy)-N-[2-[2-[[2-(2,4-dichlorophenoxy)acetyl]amino]phenyl]phenyl]acetamide has a molecular weight of 590.29 g/mol, XLogP of 8.00, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenoxy)-N-[2-[2-[[2-(2,4-dichlorophenoxy)acetyl]amino]phenyl]phenyl]acetamide is sourced from PubChem (CID 2198238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).