2-chloro-4-[[2-(4-chloro-2-methylphenoxy)acetyl]amino]benzamide

C16H14Cl2N2O3 — CID 55611309

IUPAC2-chloro-4-[[2-(4-chloro-2-methylphenoxy)acetyl]amino]benzamide
SMILESCc1cc(Cl)ccc1OCC(=O)Nc1ccc(C(N)=O)c(Cl)c1
InChIInChI=1S/C16H14Cl2N2O3/c1-9-6-10(17)2-5-14(9)23-8-15(21)20-11-3-4-12(16(19)22)13(18)7-11/h2-7H,8H2,1H3,(H2,19,22)(H,20,21)
InChIKeyQBWQENIIALUXPA-UHFFFAOYSA-N
MW353.21 g/mol
LogP3.42
Rot. Bonds5

About 2-chloro-4-[[2-(4-chloro-2-methylphenoxy)acetyl]amino]benzamide

2-chloro-4-[[2-(4-chloro-2-methylphenoxy)acetyl]amino]benzamide (PubChem CID 55611309) has the molecular formula C16H14Cl2N2O3 and a molecular weight of 353.21 g/mol. Its IUPAC name is 2-chloro-4-[[2-(4-chloro-2-methylphenoxy)acetyl]amino]benzamide.

Molecular Properties

Compound Name2-chloro-4-[[2-(4-chloro-2-methylphenoxy)acetyl]amino]benzamide
PubChem CID55611309
Molecular FormulaC16H14Cl2N2O3
Molecular Weight353.21 g/mol
Exact Mass352.04
IUPAC Name2-chloro-4-[[2-(4-chloro-2-methylphenoxy)acetyl]amino]benzamide
SMILESCc1cc(Cl)ccc1OCC(=O)Nc1ccc(C(N)=O)c(Cl)c1
InChIInChI=1S/C16H14Cl2N2O3/c1-9-6-10(17)2-5-14(9)23-8-15(21)20-11-3-4-12(16(19)22)13(18)7-11/h2-7H,8H2,1H3,(H2,19,22)(H,20,21)
InChIKeyQBWQENIIALUXPA-UHFFFAOYSA-N
XLogP3.42
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.21
LogP ≤ 53.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-aminophenyl)-2-(4-chloro-2-methylphenoxy)acetamide
CID 16789348
N-(3-amino-4-fluorophenyl)-2-(4-chloro-2-methylphenoxy)acetamide
CID 29036010
N-(3-chloro-4-fluorophenyl)-2-(2,4-dimethylphenoxy)acetamide
CID 800993
N-(3-amino-4-methoxyphenyl)-2-(4-chloro-2-methylphenoxy)acetamide
CID 50878679
2-(4-chloro-2-methylphenoxy)-N-(2,4-dichlorophenyl)acetamide
CID 923084
2-[2-(3-chloro-4-methoxyanilino)-2-oxoethoxy]-4-methoxybenzamide
CID 18085792
N-(2-amino-4-chlorophenyl)-2-(4-chloro-2-methylphenoxy)acetamide
CID 29045302
N-[4-(4-acetylpiperazin-1-yl)-3-chlorophenyl]-2-(4-chloro-2-methylphenoxy)acetamide
CID 4021519
2-(4-chloro-2-methylphenoxy)-N-(3,5-dibromo-4-hydroxyphenyl)acetamide
CID 5119772
[2-(3-fluoro-4-methylanilino)-2-oxoethyl] 2-(4-chloro-2-methylphenoxy)acetate
CID 8021076
2-(2-acetyl-4-chlorophenoxy)-N-(3,4-dimethylphenyl)acetamide
CID 7167750
2-(4-chloro-2-methylphenoxy)-N-(2,6-dimethylphenyl)acetamide
CID 803437

Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-[[2-(4-chloro-2-methylphenoxy)acetyl]amino]benzamide?
The IUPAC name of 2-chloro-4-[[2-(4-chloro-2-methylphenoxy)acetyl]amino]benzamide (CID 55611309) is 2-chloro-4-[[2-(4-chloro-2-methylphenoxy)acetyl]amino]benzamide.
What is the SMILES notation for 2-chloro-4-[[2-(4-chloro-2-methylphenoxy)acetyl]amino]benzamide?
The canonical SMILES for 2-chloro-4-[[2-(4-chloro-2-methylphenoxy)acetyl]amino]benzamide is Cc1cc(Cl)ccc1OCC(=O)Nc1ccc(C(N)=O)c(Cl)c1.
What is the InChIKey of 2-chloro-4-[[2-(4-chloro-2-methylphenoxy)acetyl]amino]benzamide?
The InChIKey is QBWQENIIALUXPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14Cl2N2O3/c1-9-6-10(17)2-5-14(9)23-8-15(21)20-11-3-4-12(16(19)22)13(18)7-11/h2-7H,8H2,1H3,(H2,19,22)(H,20,21).
What are the key properties of 2-chloro-4-[[2-(4-chloro-2-methylphenoxy)acetyl]amino]benzamide?
2-chloro-4-[[2-(4-chloro-2-methylphenoxy)acetyl]amino]benzamide has a molecular weight of 353.21 g/mol, XLogP of 3.42, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-[[2-(4-chloro-2-methylphenoxy)acetyl]amino]benzamide is sourced from PubChem (CID 55611309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).