2-(2,6-dichlorophenyl)-N-(2,3-dimethylphenyl)-N-methylacetamide

C17H17Cl2NO — CID 52705078

IUPAC2-(2,6-dichlorophenyl)-N-(2,3-dimethylphenyl)-N-methylacetamide
SMILESCc1cccc(N(C)C(=O)Cc2c(Cl)cccc2Cl)c1C
InChIInChI=1S/C17H17Cl2NO/c1-11-6-4-9-16(12(11)2)20(3)17(21)10-13-14(18)7-5-8-15(13)19/h4-9H,10H2,1-3H3
InChIKeyLUVSEHQUUJIEFL-UHFFFAOYSA-N
MW322.24 g/mol
LogP4.82
Rot. Bonds3

About 2-(2,6-dichlorophenyl)-N-(2,3-dimethylphenyl)-N-methylacetamide

2-(2,6-dichlorophenyl)-N-(2,3-dimethylphenyl)-N-methylacetamide (PubChem CID 52705078) has the molecular formula C17H17Cl2NO and a molecular weight of 322.24 g/mol. Its IUPAC name is 2-(2,6-dichlorophenyl)-N-(2,3-dimethylphenyl)-N-methylacetamide.

Molecular Properties

Compound Name2-(2,6-dichlorophenyl)-N-(2,3-dimethylphenyl)-N-methylacetamide
PubChem CID52705078
Molecular FormulaC17H17Cl2NO
Molecular Weight322.24 g/mol
Exact Mass321.07
IUPAC Name2-(2,6-dichlorophenyl)-N-(2,3-dimethylphenyl)-N-methylacetamide
SMILESCc1cccc(N(C)C(=O)Cc2c(Cl)cccc2Cl)c1C
InChIInChI=1S/C17H17Cl2NO/c1-11-6-4-9-16(12(11)2)20(3)17(21)10-13-14(18)7-5-8-15(13)19/h4-9H,10H2,1-3H3
InChIKeyLUVSEHQUUJIEFL-UHFFFAOYSA-N
XLogP4.82
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.24
LogP ≤ 54.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2,3-dimethylphenyl)-N-methyl-2-(2,3,4,5,6-pentafluorophenyl)acetamide
CID 166187270
2-bromo-N-(2,3-dimethylphenyl)-N-methylacetamide
CID 10682477
2-(2,6-dichlorophenyl)-N-(1-hydroxy-2-methylpropan-2-yl)-N-methylacetamide
CID 113476141
2-[[2-(2,6-dichlorophenyl)acetyl]-[2-(dimethylamino)ethyl]amino]acetic acid
CID 103802737
2-[(2,6-dichlorophenyl)methyl-methylamino]-N-(2,3-dimethylphenyl)acetamide
CID 9287814
N-(1-aminopropan-2-yl)-2-(2,6-dichlorophenyl)-N-methylacetamide
CID 119584839
1-(2,6-dichlorophenyl)-3-(dimethylamino)-3-methylbutan-2-one
CID 79046022
N-methyl-N-phenyl-2-(N,2,3-trimethylanilino)acetamide
CID 60525145
N-(2,3-dimethylphenyl)-N-methyl-2-(3-oxo-1,4-benzoxazin-4-yl)acetamide
CID 47064356
N-(2-chlorophenyl)-N-methylbutanamide
CID 12936039
1-(5-chloro-2-methylphenyl)-2-(2,6-dichlorophenyl)ethanone
CID 114966275
N-(2,3-dimethylphenyl)-4-iodo-N-methylbenzamide
CID 47313955

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dichlorophenyl)-N-(2,3-dimethylphenyl)-N-methylacetamide?
The IUPAC name of 2-(2,6-dichlorophenyl)-N-(2,3-dimethylphenyl)-N-methylacetamide (CID 52705078) is 2-(2,6-dichlorophenyl)-N-(2,3-dimethylphenyl)-N-methylacetamide.
What is the SMILES notation for 2-(2,6-dichlorophenyl)-N-(2,3-dimethylphenyl)-N-methylacetamide?
The canonical SMILES for 2-(2,6-dichlorophenyl)-N-(2,3-dimethylphenyl)-N-methylacetamide is Cc1cccc(N(C)C(=O)Cc2c(Cl)cccc2Cl)c1C.
What is the InChIKey of 2-(2,6-dichlorophenyl)-N-(2,3-dimethylphenyl)-N-methylacetamide?
The InChIKey is LUVSEHQUUJIEFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17Cl2NO/c1-11-6-4-9-16(12(11)2)20(3)17(21)10-13-14(18)7-5-8-15(13)19/h4-9H,10H2,1-3H3.
What are the key properties of 2-(2,6-dichlorophenyl)-N-(2,3-dimethylphenyl)-N-methylacetamide?
2-(2,6-dichlorophenyl)-N-(2,3-dimethylphenyl)-N-methylacetamide has a molecular weight of 322.24 g/mol, XLogP of 4.82, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dichlorophenyl)-N-(2,3-dimethylphenyl)-N-methylacetamide is sourced from PubChem (CID 52705078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).