N-(2,6-dichlorophenyl)-2-(4-methylanilino)acetamide

C15H14Cl2N2O — CID 39445182

IUPACN-(2,6-dichlorophenyl)-2-(4-methylanilino)acetamide
SMILESCc1ccc(NCC(=O)Nc2c(Cl)cccc2Cl)cc1
InChIInChI=1S/C15H14Cl2N2O/c1-10-5-7-11(8-6-10)18-9-14(20)19-15-12(16)3-2-4-13(15)17/h2-8,18H,9H2,1H3,(H,19,20)
InChIKeyUVARUGOZBMTQPV-UHFFFAOYSA-N
MW309.20 g/mol
LogP4.35
Rot. Bonds4

About N-(2,6-dichlorophenyl)-2-(4-methylanilino)acetamide

N-(2,6-dichlorophenyl)-2-(4-methylanilino)acetamide (PubChem CID 39445182) has the molecular formula C15H14Cl2N2O and a molecular weight of 309.20 g/mol. Its IUPAC name is N-(2,6-dichlorophenyl)-2-(4-methylanilino)acetamide.

Molecular Properties

Compound NameN-(2,6-dichlorophenyl)-2-(4-methylanilino)acetamide
PubChem CID39445182
Molecular FormulaC15H14Cl2N2O
Molecular Weight309.20 g/mol
Exact Mass308.05
IUPAC NameN-(2,6-dichlorophenyl)-2-(4-methylanilino)acetamide
SMILESCc1ccc(NCC(=O)Nc2c(Cl)cccc2Cl)cc1
InChIInChI=1S/C15H14Cl2N2O/c1-10-5-7-11(8-6-10)18-9-14(20)19-15-12(16)3-2-4-13(15)17/h2-8,18H,9H2,1H3,(H,19,20)
InChIKeyUVARUGOZBMTQPV-UHFFFAOYSA-N
XLogP4.35
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.20
LogP ≤ 54.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2,6-dichlorophenyl)-2-(4-methylanilino)acetamide?
The IUPAC name of N-(2,6-dichlorophenyl)-2-(4-methylanilino)acetamide (CID 39445182) is N-(2,6-dichlorophenyl)-2-(4-methylanilino)acetamide.
What is the SMILES notation for N-(2,6-dichlorophenyl)-2-(4-methylanilino)acetamide?
The canonical SMILES for N-(2,6-dichlorophenyl)-2-(4-methylanilino)acetamide is Cc1ccc(NCC(=O)Nc2c(Cl)cccc2Cl)cc1.
What is the InChIKey of N-(2,6-dichlorophenyl)-2-(4-methylanilino)acetamide?
The InChIKey is UVARUGOZBMTQPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14Cl2N2O/c1-10-5-7-11(8-6-10)18-9-14(20)19-15-12(16)3-2-4-13(15)17/h2-8,18H,9H2,1H3,(H,19,20).
What are the key properties of N-(2,6-dichlorophenyl)-2-(4-methylanilino)acetamide?
N-(2,6-dichlorophenyl)-2-(4-methylanilino)acetamide has a molecular weight of 309.20 g/mol, XLogP of 4.35, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dichlorophenyl)-2-(4-methylanilino)acetamide is sourced from PubChem (CID 39445182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).