3,6-dichloro-N-(2-ethoxyphenyl)-2-methoxybenzamide

C16H15Cl2NO3 — CID 707490

IUPAC3,6-dichloro-N-(2-ethoxyphenyl)-2-methoxybenzamide
SMILESCCOc1ccccc1NC(=O)c1c(Cl)ccc(Cl)c1OC
InChIInChI=1S/C16H15Cl2NO3/c1-3-22-13-7-5-4-6-12(13)19-16(20)14-10(17)8-9-11(18)15(14)21-2/h4-9H,3H2,1-2H3,(H,19,20)
InChIKeyAAXAIRZTLQXHGF-UHFFFAOYSA-N
MW340.21 g/mol
LogP4.65
Rot. Bonds5

About 3,6-dichloro-N-(2-ethoxyphenyl)-2-methoxybenzamide

3,6-dichloro-N-(2-ethoxyphenyl)-2-methoxybenzamide (PubChem CID 707490) has the molecular formula C16H15Cl2NO3 and a molecular weight of 340.21 g/mol. Its IUPAC name is 3,6-dichloro-N-(2-ethoxyphenyl)-2-methoxybenzamide.

Molecular Properties

Compound Name3,6-dichloro-N-(2-ethoxyphenyl)-2-methoxybenzamide
PubChem CID707490
Molecular FormulaC16H15Cl2NO3
Molecular Weight340.21 g/mol
Exact Mass339.04
IUPAC Name3,6-dichloro-N-(2-ethoxyphenyl)-2-methoxybenzamide
SMILESCCOc1ccccc1NC(=O)c1c(Cl)ccc(Cl)c1OC
InChIInChI=1S/C16H15Cl2NO3/c1-3-22-13-7-5-4-6-12(13)19-16(20)14-10(17)8-9-11(18)15(14)21-2/h4-9H,3H2,1-2H3,(H,19,20)
InChIKeyAAXAIRZTLQXHGF-UHFFFAOYSA-N
XLogP4.65
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.21
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3,6-dichloro-N-(2-ethoxyphenyl)-2-methoxybenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3,6-dichloro-N-(2-ethoxyphenyl)-2-methoxybenzamide?
The IUPAC name of 3,6-dichloro-N-(2-ethoxyphenyl)-2-methoxybenzamide (CID 707490) is 3,6-dichloro-N-(2-ethoxyphenyl)-2-methoxybenzamide.
What is the SMILES notation for 3,6-dichloro-N-(2-ethoxyphenyl)-2-methoxybenzamide?
The canonical SMILES for 3,6-dichloro-N-(2-ethoxyphenyl)-2-methoxybenzamide is CCOc1ccccc1NC(=O)c1c(Cl)ccc(Cl)c1OC.
What is the InChIKey of 3,6-dichloro-N-(2-ethoxyphenyl)-2-methoxybenzamide?
The InChIKey is AAXAIRZTLQXHGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15Cl2NO3/c1-3-22-13-7-5-4-6-12(13)19-16(20)14-10(17)8-9-11(18)15(14)21-2/h4-9H,3H2,1-2H3,(H,19,20).
What are the key properties of 3,6-dichloro-N-(2-ethoxyphenyl)-2-methoxybenzamide?
3,6-dichloro-N-(2-ethoxyphenyl)-2-methoxybenzamide has a molecular weight of 340.21 g/mol, XLogP of 4.65, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-dichloro-N-(2-ethoxyphenyl)-2-methoxybenzamide is sourced from PubChem (CID 707490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).