4-acetamido-5-chloro-N-(2,3-dichlorophenyl)-2-methoxybenzamide

C16H13Cl3N2O3 — CID 17257142

IUPAC4-acetamido-5-chloro-N-(2,3-dichlorophenyl)-2-methoxybenzamide
SMILESCOc1cc(NC(C)=O)c(Cl)cc1C(=O)Nc1cccc(Cl)c1Cl
InChIInChI=1S/C16H13Cl3N2O3/c1-8(22)20-13-7-14(24-2)9(6-11(13)18)16(23)21-12-5-3-4-10(17)15(12)19/h3-7H,1-2H3,(H,20,22)(H,21,23)
InChIKeyRAFANPZHVCCFHT-UHFFFAOYSA-N
MW387.65 g/mol
LogP4.87
Rot. Bonds4

About 4-acetamido-5-chloro-N-(2,3-dichlorophenyl)-2-methoxybenzamide

4-acetamido-5-chloro-N-(2,3-dichlorophenyl)-2-methoxybenzamide (PubChem CID 17257142) has the molecular formula C16H13Cl3N2O3 and a molecular weight of 387.65 g/mol. Its IUPAC name is 4-acetamido-5-chloro-N-(2,3-dichlorophenyl)-2-methoxybenzamide.

Molecular Properties

Compound Name4-acetamido-5-chloro-N-(2,3-dichlorophenyl)-2-methoxybenzamide
PubChem CID17257142
Molecular FormulaC16H13Cl3N2O3
Molecular Weight387.65 g/mol
Exact Mass386.00
IUPAC Name4-acetamido-5-chloro-N-(2,3-dichlorophenyl)-2-methoxybenzamide
SMILESCOc1cc(NC(C)=O)c(Cl)cc1C(=O)Nc1cccc(Cl)c1Cl
InChIInChI=1S/C16H13Cl3N2O3/c1-8(22)20-13-7-14(24-2)9(6-11(13)18)16(23)21-12-5-3-4-10(17)15(12)19/h3-7H,1-2H3,(H,20,22)(H,21,23)
InChIKeyRAFANPZHVCCFHT-UHFFFAOYSA-N
XLogP4.87
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.65
LogP ≤ 54.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-acetamido-5-chloro-N-(2,3-dichlorophenyl)-2-methoxybenzamide?
The IUPAC name of 4-acetamido-5-chloro-N-(2,3-dichlorophenyl)-2-methoxybenzamide (CID 17257142) is 4-acetamido-5-chloro-N-(2,3-dichlorophenyl)-2-methoxybenzamide.
What is the SMILES notation for 4-acetamido-5-chloro-N-(2,3-dichlorophenyl)-2-methoxybenzamide?
The canonical SMILES for 4-acetamido-5-chloro-N-(2,3-dichlorophenyl)-2-methoxybenzamide is COc1cc(NC(C)=O)c(Cl)cc1C(=O)Nc1cccc(Cl)c1Cl.
What is the InChIKey of 4-acetamido-5-chloro-N-(2,3-dichlorophenyl)-2-methoxybenzamide?
The InChIKey is RAFANPZHVCCFHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13Cl3N2O3/c1-8(22)20-13-7-14(24-2)9(6-11(13)18)16(23)21-12-5-3-4-10(17)15(12)19/h3-7H,1-2H3,(H,20,22)(H,21,23).
What are the key properties of 4-acetamido-5-chloro-N-(2,3-dichlorophenyl)-2-methoxybenzamide?
4-acetamido-5-chloro-N-(2,3-dichlorophenyl)-2-methoxybenzamide has a molecular weight of 387.65 g/mol, XLogP of 4.87, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-acetamido-5-chloro-N-(2,3-dichlorophenyl)-2-methoxybenzamide is sourced from PubChem (CID 17257142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).