2-(2,6-dichlorophenyl)-N-(2,6-diethylphenyl)acetamide

C18H19Cl2NO — CID 7700454

IUPAC2-(2,6-dichlorophenyl)-N-(2,6-diethylphenyl)acetamide
SMILESCCc1cccc(CC)c1NC(=O)Cc1c(Cl)cccc1Cl
InChIInChI=1S/C18H19Cl2NO/c1-3-12-7-5-8-13(4-2)18(12)21-17(22)11-14-15(19)9-6-10-16(14)20/h5-10H,3-4,11H2,1-2H3,(H,21,22)
InChIKeyKHVZHSCPQQBNJZ-UHFFFAOYSA-N
MW336.26 g/mol
LogP5.30
Rot. Bonds5

About 2-(2,6-dichlorophenyl)-N-(2,6-diethylphenyl)acetamide

2-(2,6-dichlorophenyl)-N-(2,6-diethylphenyl)acetamide (PubChem CID 7700454) has the molecular formula C18H19Cl2NO and a molecular weight of 336.26 g/mol. Its IUPAC name is 2-(2,6-dichlorophenyl)-N-(2,6-diethylphenyl)acetamide.

Molecular Properties

Compound Name2-(2,6-dichlorophenyl)-N-(2,6-diethylphenyl)acetamide
PubChem CID7700454
Molecular FormulaC18H19Cl2NO
Molecular Weight336.26 g/mol
Exact Mass335.08
IUPAC Name2-(2,6-dichlorophenyl)-N-(2,6-diethylphenyl)acetamide
SMILESCCc1cccc(CC)c1NC(=O)Cc1c(Cl)cccc1Cl
InChIInChI=1S/C18H19Cl2NO/c1-3-12-7-5-8-13(4-2)18(12)21-17(22)11-14-15(19)9-6-10-16(14)20/h5-10H,3-4,11H2,1-2H3,(H,21,22)
InChIKeyKHVZHSCPQQBNJZ-UHFFFAOYSA-N
XLogP5.30
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500336.26
LogP ≤ 55.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2-chloro-6-ethylphenyl)acetamide
CID 130011952
3-[(2-chlorophenyl)methylamino]-N-(2,6-diethylphenyl)propanamide
CID 109021543
[2-(2,6-diethylanilino)-2-oxoethyl] 2-(2-chloro-6-fluorophenyl)acetate
CID 7718355
N-(2,6-diethylphenyl)-2-(2-hydroxyphenyl)acetamide
CID 80723226
1-(2-chlorophenyl)-3-(2,6-diethylphenyl)urea
CID 4994979
2-(2,6-dichlorophenyl)-N-(3,5-dimethyl-1,2-oxazol-4-yl)acetamide
CID 51098104
2-(2-chloro-6-fluorophenyl)-N-(2-ethylphenyl)acetamide
CID 839109
2-(2,6-dichlorophenyl)-N-(2-hydroxynaphthalen-1-yl)acetamide
CID 8797412
3-amino-N-(2,6-diethylphenyl)-3-sulfanylidenepropanamide
CID 28942377
N-(2,6-diethylphenyl)-4-oxopentanamide
CID 65419318
N-(2-chlorophenyl)-2-[4-[2-(2,6-diethylanilino)-2-oxoethyl]piperazin-1-yl]acetamide
CID 29161563
2-[4-[[2-(2,6-dichlorophenyl)acetyl]amino]phenyl]-N-methylacetamide
CID 134062889

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dichlorophenyl)-N-(2,6-diethylphenyl)acetamide?
The IUPAC name of 2-(2,6-dichlorophenyl)-N-(2,6-diethylphenyl)acetamide (CID 7700454) is 2-(2,6-dichlorophenyl)-N-(2,6-diethylphenyl)acetamide.
What is the SMILES notation for 2-(2,6-dichlorophenyl)-N-(2,6-diethylphenyl)acetamide?
The canonical SMILES for 2-(2,6-dichlorophenyl)-N-(2,6-diethylphenyl)acetamide is CCc1cccc(CC)c1NC(=O)Cc1c(Cl)cccc1Cl.
What is the InChIKey of 2-(2,6-dichlorophenyl)-N-(2,6-diethylphenyl)acetamide?
The InChIKey is KHVZHSCPQQBNJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19Cl2NO/c1-3-12-7-5-8-13(4-2)18(12)21-17(22)11-14-15(19)9-6-10-16(14)20/h5-10H,3-4,11H2,1-2H3,(H,21,22).
What are the key properties of 2-(2,6-dichlorophenyl)-N-(2,6-diethylphenyl)acetamide?
2-(2,6-dichlorophenyl)-N-(2,6-diethylphenyl)acetamide has a molecular weight of 336.26 g/mol, XLogP of 5.30, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dichlorophenyl)-N-(2,6-diethylphenyl)acetamide is sourced from PubChem (CID 7700454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).