4-[[2-(2,3-dichlorophenoxy)acetyl]amino]-N-methylbenzamide

C16H14Cl2N2O3 — CID 9286555

IUPAC4-[[2-(2,3-dichlorophenoxy)acetyl]amino]-N-methylbenzamide
SMILESCNC(=O)c1ccc(NC(=O)COc2cccc(Cl)c2Cl)cc1
InChIInChI=1S/C16H14Cl2N2O3/c1-19-16(22)10-5-7-11(8-6-10)20-14(21)9-23-13-4-2-3-12(17)15(13)18/h2-8H,9H2,1H3,(H,19,22)(H,20,21)
InChIKeyFTQSNRABEMLOQH-UHFFFAOYSA-N
MW353.21 g/mol
LogP3.37
Rot. Bonds5

About 4-[[2-(2,3-dichlorophenoxy)acetyl]amino]-N-methylbenzamide

4-[[2-(2,3-dichlorophenoxy)acetyl]amino]-N-methylbenzamide (PubChem CID 9286555) has the molecular formula C16H14Cl2N2O3 and a molecular weight of 353.21 g/mol. Its IUPAC name is 4-[[2-(2,3-dichlorophenoxy)acetyl]amino]-N-methylbenzamide.

Molecular Properties

Compound Name4-[[2-(2,3-dichlorophenoxy)acetyl]amino]-N-methylbenzamide
PubChem CID9286555
Molecular FormulaC16H14Cl2N2O3
Molecular Weight353.21 g/mol
Exact Mass352.04
IUPAC Name4-[[2-(2,3-dichlorophenoxy)acetyl]amino]-N-methylbenzamide
SMILESCNC(=O)c1ccc(NC(=O)COc2cccc(Cl)c2Cl)cc1
InChIInChI=1S/C16H14Cl2N2O3/c1-19-16(22)10-5-7-11(8-6-10)20-14(21)9-23-13-4-2-3-12(17)15(13)18/h2-8H,9H2,1H3,(H,19,22)(H,20,21)
InChIKeyFTQSNRABEMLOQH-UHFFFAOYSA-N
XLogP3.37
TPSA67.43 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 ≤ 53.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,3-dichlorophenoxy)-N-(4-methylphenyl)acetamide
CID 2602907
4-[[2-(4-chloronaphthalen-1-yl)oxyacetyl]amino]-N-methylbenzamide
CID 9230997
2-(2,3-dichlorophenoxy)-N-(3,4-dimethylphenyl)acetamide
CID 30157512
4-[[2-(2-bromo-4-chlorophenoxy)acetyl]amino]-N-methylbenzamide
CID 8807740
4-[[2-(4-bromo-2-chlorophenoxy)acetyl]amino]-N-methylbenzamide
CID 9289895
2-(2,3-dichlorophenoxy)-N-(3,5-dimethylphenyl)acetamide
CID 7787801
N-[3-[[2-(2,3-dichlorophenoxy)acetyl]amino]phenyl]pyridine-4-carboxamide
CID 144576139
4-tert-butyl-N-[4-[[2-(2-chlorophenoxy)acetyl]amino]phenyl]benzamide
CID 1221634
4-[[2-(2-chlorophenoxy)acetyl]amino]-N-(2-methoxyethyl)benzamide
CID 17218233
2-[[4-[[2-(2-chlorophenoxy)acetyl]amino]benzoyl]amino]acetic acid
CID 45434890
4-[[2-(2-chlorophenoxy)acetyl]amino]-N,N-dimethylbenzamide
CID 2631997
4-[[2-(1-bromonaphthalen-2-yl)oxyacetyl]amino]-N-methylbenzamide
CID 24605889

Frequently Asked Questions

What is the IUPAC name of 4-[[2-(2,3-dichlorophenoxy)acetyl]amino]-N-methylbenzamide?
The IUPAC name of 4-[[2-(2,3-dichlorophenoxy)acetyl]amino]-N-methylbenzamide (CID 9286555) is 4-[[2-(2,3-dichlorophenoxy)acetyl]amino]-N-methylbenzamide.
What is the SMILES notation for 4-[[2-(2,3-dichlorophenoxy)acetyl]amino]-N-methylbenzamide?
The canonical SMILES for 4-[[2-(2,3-dichlorophenoxy)acetyl]amino]-N-methylbenzamide is CNC(=O)c1ccc(NC(=O)COc2cccc(Cl)c2Cl)cc1.
What is the InChIKey of 4-[[2-(2,3-dichlorophenoxy)acetyl]amino]-N-methylbenzamide?
The InChIKey is FTQSNRABEMLOQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14Cl2N2O3/c1-19-16(22)10-5-7-11(8-6-10)20-14(21)9-23-13-4-2-3-12(17)15(13)18/h2-8H,9H2,1H3,(H,19,22)(H,20,21).
What are the key properties of 4-[[2-(2,3-dichlorophenoxy)acetyl]amino]-N-methylbenzamide?
4-[[2-(2,3-dichlorophenoxy)acetyl]amino]-N-methylbenzamide has a molecular weight of 353.21 g/mol, XLogP of 3.37, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2-(2,3-dichlorophenoxy)acetyl]amino]-N-methylbenzamide is sourced from PubChem (CID 9286555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).