N-(2-tert-butylphenyl)-2-(2,6-dichlorophenyl)acetamide

C18H19Cl2NO — CID 7920165

IUPACN-(2-tert-butylphenyl)-2-(2,6-dichlorophenyl)acetamide
SMILESCC(C)(C)c1ccccc1NC(=O)Cc1c(Cl)cccc1Cl
InChIInChI=1S/C18H19Cl2NO/c1-18(2,3)13-7-4-5-10-16(13)21-17(22)11-12-14(19)8-6-9-15(12)20/h4-10H,11H2,1-3H3,(H,21,22)
InChIKeyOWSCMDBDTFCKQR-UHFFFAOYSA-N
MW336.26 g/mol
LogP5.47
Rot. Bonds3

About N-(2-tert-butylphenyl)-2-(2,6-dichlorophenyl)acetamide

N-(2-tert-butylphenyl)-2-(2,6-dichlorophenyl)acetamide (PubChem CID 7920165) has the molecular formula C18H19Cl2NO and a molecular weight of 336.26 g/mol. Its IUPAC name is N-(2-tert-butylphenyl)-2-(2,6-dichlorophenyl)acetamide.

Molecular Properties

Compound NameN-(2-tert-butylphenyl)-2-(2,6-dichlorophenyl)acetamide
PubChem CID7920165
Molecular FormulaC18H19Cl2NO
Molecular Weight336.26 g/mol
Exact Mass335.08
IUPAC NameN-(2-tert-butylphenyl)-2-(2,6-dichlorophenyl)acetamide
SMILESCC(C)(C)c1ccccc1NC(=O)Cc1c(Cl)cccc1Cl
InChIInChI=1S/C18H19Cl2NO/c1-18(2,3)13-7-4-5-10-16(13)21-17(22)11-12-14(19)8-6-9-15(12)20/h4-10H,11H2,1-3H3,(H,21,22)
InChIKeyOWSCMDBDTFCKQR-UHFFFAOYSA-N
XLogP5.47
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500336.26
LogP ≤ 55.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2-tert-butylphenyl)-N'-(2,6-dichlorophenyl)propanediamide
CID 108954677
N-(2-tert-butylphenyl)-2-(3-chloro-2-methylanilino)acetamide
CID 109008221
N-(2-tert-butylphenyl)-2-[(2-chlorophenyl)methylamino]acetamide
CID 108997968
N-(2-acetylphenyl)-2-(2,6-dichlorophenyl)acetamide
CID 4800695
2-tert-butyl-N-[(2,6-dichlorophenyl)methyl]aniline
CID 43229696
3-(2-tert-butylanilino)-N-(2-chlorophenyl)propanamide
CID 109037305
N-(2-tert-butylphenyl)-2-(4-methoxyphenyl)acetamide
CID 890877
3-[[2-(2,6-dichlorophenyl)acetyl]amino]-N,N,2-trimethylbenzamide
CID 131902894
N-(2-tert-butylphenyl)-2-methylsulfanylacetamide
CID 67575618
N-(2-tert-butylphenyl)-2-(prop-2-ynylamino)acetamide
CID 78912848
N-(2-tert-butylphenyl)-5-chloropentanamide
CID 43697568
2-(2-chloro-6-fluorophenyl)-N-(2-ethylphenyl)acetamide
CID 839109

Frequently Asked Questions

What is the IUPAC name of N-(2-tert-butylphenyl)-2-(2,6-dichlorophenyl)acetamide?
The IUPAC name of N-(2-tert-butylphenyl)-2-(2,6-dichlorophenyl)acetamide (CID 7920165) is N-(2-tert-butylphenyl)-2-(2,6-dichlorophenyl)acetamide.
What is the SMILES notation for N-(2-tert-butylphenyl)-2-(2,6-dichlorophenyl)acetamide?
The canonical SMILES for N-(2-tert-butylphenyl)-2-(2,6-dichlorophenyl)acetamide is CC(C)(C)c1ccccc1NC(=O)Cc1c(Cl)cccc1Cl.
What is the InChIKey of N-(2-tert-butylphenyl)-2-(2,6-dichlorophenyl)acetamide?
The InChIKey is OWSCMDBDTFCKQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19Cl2NO/c1-18(2,3)13-7-4-5-10-16(13)21-17(22)11-12-14(19)8-6-9-15(12)20/h4-10H,11H2,1-3H3,(H,21,22).
What are the key properties of N-(2-tert-butylphenyl)-2-(2,6-dichlorophenyl)acetamide?
N-(2-tert-butylphenyl)-2-(2,6-dichlorophenyl)acetamide has a molecular weight of 336.26 g/mol, XLogP of 5.47, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-tert-butylphenyl)-2-(2,6-dichlorophenyl)acetamide is sourced from PubChem (CID 7920165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).