N-(2,6-dichlorophenyl)-2,3,4-trimethoxybenzamide

C16H15Cl2NO4 — CID 2347602

IUPACN-(2,6-dichlorophenyl)-2,3,4-trimethoxybenzamide
SMILESCOc1ccc(C(=O)Nc2c(Cl)cccc2Cl)c(OC)c1OC
InChIInChI=1S/C16H15Cl2NO4/c1-21-12-8-7-9(14(22-2)15(12)23-3)16(20)19-13-10(17)5-4-6-11(13)18/h4-8H,1-3H3,(H,19,20)
InChIKeyGIIPDJLSYMTCNF-UHFFFAOYSA-N
MW356.21 g/mol
LogP4.27
Rot. Bonds5

About N-(2,6-dichlorophenyl)-2,3,4-trimethoxybenzamide

N-(2,6-dichlorophenyl)-2,3,4-trimethoxybenzamide (PubChem CID 2347602) has the molecular formula C16H15Cl2NO4 and a molecular weight of 356.21 g/mol. Its IUPAC name is N-(2,6-dichlorophenyl)-2,3,4-trimethoxybenzamide.

Molecular Properties

Compound NameN-(2,6-dichlorophenyl)-2,3,4-trimethoxybenzamide
PubChem CID2347602
Molecular FormulaC16H15Cl2NO4
Molecular Weight356.21 g/mol
Exact Mass355.04
IUPAC NameN-(2,6-dichlorophenyl)-2,3,4-trimethoxybenzamide
SMILESCOc1ccc(C(=O)Nc2c(Cl)cccc2Cl)c(OC)c1OC
InChIInChI=1S/C16H15Cl2NO4/c1-21-12-8-7-9(14(22-2)15(12)23-3)16(20)19-13-10(17)5-4-6-11(13)18/h4-8H,1-3H3,(H,19,20)
InChIKeyGIIPDJLSYMTCNF-UHFFFAOYSA-N
XLogP4.27
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.21
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2,6-dichlorophenyl)-2,3,4-trimethoxybenzamide?
The IUPAC name of N-(2,6-dichlorophenyl)-2,3,4-trimethoxybenzamide (CID 2347602) is N-(2,6-dichlorophenyl)-2,3,4-trimethoxybenzamide.
What is the SMILES notation for N-(2,6-dichlorophenyl)-2,3,4-trimethoxybenzamide?
The canonical SMILES for N-(2,6-dichlorophenyl)-2,3,4-trimethoxybenzamide is COc1ccc(C(=O)Nc2c(Cl)cccc2Cl)c(OC)c1OC.
What is the InChIKey of N-(2,6-dichlorophenyl)-2,3,4-trimethoxybenzamide?
The InChIKey is GIIPDJLSYMTCNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15Cl2NO4/c1-21-12-8-7-9(14(22-2)15(12)23-3)16(20)19-13-10(17)5-4-6-11(13)18/h4-8H,1-3H3,(H,19,20).
What are the key properties of N-(2,6-dichlorophenyl)-2,3,4-trimethoxybenzamide?
N-(2,6-dichlorophenyl)-2,3,4-trimethoxybenzamide has a molecular weight of 356.21 g/mol, XLogP of 4.27, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dichlorophenyl)-2,3,4-trimethoxybenzamide is sourced from PubChem (CID 2347602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).