2-(2,5-dichloro-N-methylsulfonylanilino)-N-(2-methylphenyl)acetamide

C16H16Cl2N2O3S — CID 1322632

IUPAC2-(2,5-dichloro-N-methylsulfonylanilino)-N-(2-methylphenyl)acetamide
SMILESCc1ccccc1NC(=O)CN(c1cc(Cl)ccc1Cl)S(C)(=O)=O
InChIInChI=1S/C16H16Cl2N2O3S/c1-11-5-3-4-6-14(11)19-16(21)10-20(24(2,22)23)15-9-12(17)7-8-13(15)18/h3-9H,10H2,1-2H3,(H,19,21)
InChIKeyDQHXMYGMWAQSKX-UHFFFAOYSA-N
MW387.29 g/mol
LogP3.71
Rot. Bonds5

About 2-(2,5-dichloro-N-methylsulfonylanilino)-N-(2-methylphenyl)acetamide

2-(2,5-dichloro-N-methylsulfonylanilino)-N-(2-methylphenyl)acetamide (PubChem CID 1322632) has the molecular formula C16H16Cl2N2O3S and a molecular weight of 387.29 g/mol. Its IUPAC name is 2-(2,5-dichloro-N-methylsulfonylanilino)-N-(2-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(2,5-dichloro-N-methylsulfonylanilino)-N-(2-methylphenyl)acetamide
PubChem CID1322632
Molecular FormulaC16H16Cl2N2O3S
Molecular Weight387.29 g/mol
Exact Mass386.03
IUPAC Name2-(2,5-dichloro-N-methylsulfonylanilino)-N-(2-methylphenyl)acetamide
SMILESCc1ccccc1NC(=O)CN(c1cc(Cl)ccc1Cl)S(C)(=O)=O
InChIInChI=1S/C16H16Cl2N2O3S/c1-11-5-3-4-6-14(11)19-16(21)10-20(24(2,22)23)15-9-12(17)7-8-13(15)18/h3-9H,10H2,1-2H3,(H,19,21)
InChIKeyDQHXMYGMWAQSKX-UHFFFAOYSA-N
XLogP3.71
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.29
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,5-dichloro-N-methylsulfonylanilino)-N-(2,5-dimethylphenyl)acetamide
CID 126034078
N-(3-chloro-4-methylphenyl)-2-(2,5-dichloro-N-methylsulfonylanilino)acetamide
CID 27056713
N-(2-chlorophenyl)-2-(2,4-dichloro-N-methylsulfonylanilino)acetamide
CID 2712015
2-(2,5-dichloro-N-methylsulfonylanilino)-N-(3,5-dimethylphenyl)acetamide
CID 1308135
2-(2,4-dimethyl-N-methylsulfonylanilino)-N-(2-methylphenyl)acetamide
CID 30168672
2-(2-bromo-N-methylsulfonylanilino)-N-(4-chloro-2-methylphenyl)acetamide
CID 2893886
2-(2,5-dichloro-N-methylsulfonylanilino)-N-(2,4-difluorophenyl)acetamide
CID 1326607
3-(4-chloro-2-methyl-N-methylsulfonylanilino)-N-(2-methylphenyl)propanamide
CID 113144144
N-(2-methylphenyl)-2-(2,3,4-trifluoro-N-methylsulfonylanilino)acetamide
CID 113157523
2-(2-chloro-N-methylsulfonylanilino)-N-(2,4-dimethylphenyl)acetamide
CID 51343170
N-(2,5-dichlorophenyl)-N-(2-hydrazinyl-2-oxoethyl)methanesulfonamide
CID 50892714
2-(5-chloro-2-methyl-N-methylsulfonylanilino)-N-phenylacetamide
CID 1204030

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dichloro-N-methylsulfonylanilino)-N-(2-methylphenyl)acetamide?
The IUPAC name of 2-(2,5-dichloro-N-methylsulfonylanilino)-N-(2-methylphenyl)acetamide (CID 1322632) is 2-(2,5-dichloro-N-methylsulfonylanilino)-N-(2-methylphenyl)acetamide.
What is the SMILES notation for 2-(2,5-dichloro-N-methylsulfonylanilino)-N-(2-methylphenyl)acetamide?
The canonical SMILES for 2-(2,5-dichloro-N-methylsulfonylanilino)-N-(2-methylphenyl)acetamide is Cc1ccccc1NC(=O)CN(c1cc(Cl)ccc1Cl)S(C)(=O)=O.
What is the InChIKey of 2-(2,5-dichloro-N-methylsulfonylanilino)-N-(2-methylphenyl)acetamide?
The InChIKey is DQHXMYGMWAQSKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16Cl2N2O3S/c1-11-5-3-4-6-14(11)19-16(21)10-20(24(2,22)23)15-9-12(17)7-8-13(15)18/h3-9H,10H2,1-2H3,(H,19,21).
What are the key properties of 2-(2,5-dichloro-N-methylsulfonylanilino)-N-(2-methylphenyl)acetamide?
2-(2,5-dichloro-N-methylsulfonylanilino)-N-(2-methylphenyl)acetamide has a molecular weight of 387.29 g/mol, XLogP of 3.71, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dichloro-N-methylsulfonylanilino)-N-(2-methylphenyl)acetamide is sourced from PubChem (CID 1322632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).