2-[[2-(2,4-dichlorophenoxy)acetyl]amino]-N-ethyl-N-phenylbenzamide

C23H20Cl2N2O3 — CID 17186619

IUPAC2-[[2-(2,4-dichlorophenoxy)acetyl]amino]-N-ethyl-N-phenylbenzamide
SMILESCCN(C(=O)c1ccccc1NC(=O)COc1ccc(Cl)cc1Cl)c1ccccc1
InChIInChI=1S/C23H20Cl2N2O3/c1-2-27(17-8-4-3-5-9-17)23(29)18-10-6-7-11-20(18)26-22(28)15-30-21-13-12-16(24)14-19(21)25/h3-14H,2,15H2,1H3,(H,26,28)
InChIKeyXDIKPVMYFHUEFL-UHFFFAOYSA-N
MW443.33 g/mol
LogP5.68
Rot. Bonds7

About 2-[[2-(2,4-dichlorophenoxy)acetyl]amino]-N-ethyl-N-phenylbenzamide

2-[[2-(2,4-dichlorophenoxy)acetyl]amino]-N-ethyl-N-phenylbenzamide (PubChem CID 17186619) has the molecular formula C23H20Cl2N2O3 and a molecular weight of 443.33 g/mol. Its IUPAC name is 2-[[2-(2,4-dichlorophenoxy)acetyl]amino]-N-ethyl-N-phenylbenzamide.

Molecular Properties

Compound Name2-[[2-(2,4-dichlorophenoxy)acetyl]amino]-N-ethyl-N-phenylbenzamide
PubChem CID17186619
Molecular FormulaC23H20Cl2N2O3
Molecular Weight443.33 g/mol
Exact Mass442.09
IUPAC Name2-[[2-(2,4-dichlorophenoxy)acetyl]amino]-N-ethyl-N-phenylbenzamide
SMILESCCN(C(=O)c1ccccc1NC(=O)COc1ccc(Cl)cc1Cl)c1ccccc1
InChIInChI=1S/C23H20Cl2N2O3/c1-2-27(17-8-4-3-5-9-17)23(29)18-10-6-7-11-20(18)26-22(28)15-30-21-13-12-16(24)14-19(21)25/h3-14H,2,15H2,1H3,(H,26,28)
InChIKeyXDIKPVMYFHUEFL-UHFFFAOYSA-N
XLogP5.68
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500443.33
LogP ≤ 55.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-benzyl-2-[[2-(2,4-dichlorophenoxy)acetyl]amino]-N-methylbenzamide
CID 4937312
2-[[2-(2-bromo-4-butan-2-ylphenoxy)acetyl]amino]-N-ethyl-N-phenylbenzamide
CID 17189648
N-(2-chlorophenyl)-2-(2,4-dichlorophenoxy)acetamide
CID 744320
2-(2,4-dichlorophenoxy)-N-[2-[2-[[2-(2,4-dichlorophenoxy)acetyl]amino]phenyl]phenyl]acetamide
CID 2198238
2-[2-[[2-(2,4-dichlorophenoxy)acetyl]amino]phenyl]acetic acid
CID 166178801
2-(2,4-dichlorophenoxy)-N-[2-(ethoxymethyl)phenyl]acetamide
CID 86821663
N-(2-benzoyl-4-chlorophenyl)-2-(2,4-dichlorophenoxy)acetamide
CID 3544695
ethyl 3-[2-[ethyl(phenyl)carbamoyl]anilino]-3-oxopropanoate
CID 17186762
2-[[2-(2,4-dibromo-6-methylphenoxy)acetyl]amino]-N-ethyl-N-phenylbenzamide
CID 17186649
3-[[2-(4-chloro-2-methylphenoxy)acetyl]amino]-N-ethyl-N-phenylbenzamide
CID 17221916
N-cyclopropyl-2-[[2-(2,4-dichlorophenoxy)acetyl]amino]benzamide
CID 7729391
methyl 2-[[2-[2-(2,4-dichlorophenoxy)phenoxy]acetyl]amino]benzoate
CID 57406612

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(2,4-dichlorophenoxy)acetyl]amino]-N-ethyl-N-phenylbenzamide?
The IUPAC name of 2-[[2-(2,4-dichlorophenoxy)acetyl]amino]-N-ethyl-N-phenylbenzamide (CID 17186619) is 2-[[2-(2,4-dichlorophenoxy)acetyl]amino]-N-ethyl-N-phenylbenzamide.
What is the SMILES notation for 2-[[2-(2,4-dichlorophenoxy)acetyl]amino]-N-ethyl-N-phenylbenzamide?
The canonical SMILES for 2-[[2-(2,4-dichlorophenoxy)acetyl]amino]-N-ethyl-N-phenylbenzamide is CCN(C(=O)c1ccccc1NC(=O)COc1ccc(Cl)cc1Cl)c1ccccc1.
What is the InChIKey of 2-[[2-(2,4-dichlorophenoxy)acetyl]amino]-N-ethyl-N-phenylbenzamide?
The InChIKey is XDIKPVMYFHUEFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20Cl2N2O3/c1-2-27(17-8-4-3-5-9-17)23(29)18-10-6-7-11-20(18)26-22(28)15-30-21-13-12-16(24)14-19(21)25/h3-14H,2,15H2,1H3,(H,26,28).
What are the key properties of 2-[[2-(2,4-dichlorophenoxy)acetyl]amino]-N-ethyl-N-phenylbenzamide?
2-[[2-(2,4-dichlorophenoxy)acetyl]amino]-N-ethyl-N-phenylbenzamide has a molecular weight of 443.33 g/mol, XLogP of 5.68, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(2,4-dichlorophenoxy)acetyl]amino]-N-ethyl-N-phenylbenzamide is sourced from PubChem (CID 17186619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).