N-(2,6-dichlorophenyl)-4-ethoxy-3-methylbenzamide

C16H15Cl2NO2 — CID 30147579

IUPACN-(2,6-dichlorophenyl)-4-ethoxy-3-methylbenzamide
SMILESCCOc1ccc(C(=O)Nc2c(Cl)cccc2Cl)cc1C
InChIInChI=1S/C16H15Cl2NO2/c1-3-21-14-8-7-11(9-10(14)2)16(20)19-15-12(17)5-4-6-13(15)18/h4-9H,3H2,1-2H3,(H,19,20)
InChIKeyVCOLHXUJNYLUKL-UHFFFAOYSA-N
MW324.21 g/mol
LogP4.95
Rot. Bonds4

About N-(2,6-dichlorophenyl)-4-ethoxy-3-methylbenzamide

N-(2,6-dichlorophenyl)-4-ethoxy-3-methylbenzamide (PubChem CID 30147579) has the molecular formula C16H15Cl2NO2 and a molecular weight of 324.21 g/mol. Its IUPAC name is N-(2,6-dichlorophenyl)-4-ethoxy-3-methylbenzamide.

Molecular Properties

Compound NameN-(2,6-dichlorophenyl)-4-ethoxy-3-methylbenzamide
PubChem CID30147579
Molecular FormulaC16H15Cl2NO2
Molecular Weight324.21 g/mol
Exact Mass323.05
IUPAC NameN-(2,6-dichlorophenyl)-4-ethoxy-3-methylbenzamide
SMILESCCOc1ccc(C(=O)Nc2c(Cl)cccc2Cl)cc1C
InChIInChI=1S/C16H15Cl2NO2/c1-3-21-14-8-7-11(9-10(14)2)16(20)19-15-12(17)5-4-6-13(15)18/h4-9H,3H2,1-2H3,(H,19,20)
InChIKeyVCOLHXUJNYLUKL-UHFFFAOYSA-N
XLogP4.95
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.21
LogP ≤ 54.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,6-dipyrrolidin-1-ylphenyl)-4-ethoxy-3-methylbenzamide
CID 86938278
N-(4-amino-3,5-dichlorophenyl)-4-ethoxy-3-methylbenzamide
CID 86938466
N-[3-(3-chloro-2-methylanilino)-3-oxopropyl]-4-ethoxy-3-methylbenzamide
CID 86938507
3-chloro-N-(3-chloro-2-methylphenyl)-4-ethoxybenzamide
CID 886779
[2-(2,6-dichloroanilino)-2-oxoethyl] 3,4-diethoxybenzoate
CID 7381928
N-(2-carbamoylphenyl)-4-ethoxy-3-methylbenzamide
CID 95970601
4-ethoxy-3-methyl-N-(2-propan-2-yloxyphenyl)benzamide
CID 86938124
3-chloro-4-ethoxy-N-(6-methylpyridin-1-ium-2-yl)benzamide
CID 4694654
3-chloro-4-ethoxy-N-(5-methyl-2,1,3-benzothiadiazol-4-yl)benzamide
CID 5091717
4-ethoxy-3-methyl-N-[3-(propan-2-yloxymethyl)phenyl]benzamide
CID 86938203
3-chloro-N-(3,5-dimethylphenyl)-4-ethoxybenzamide
CID 806791
4-ethoxy-3-methyl-N-[3-(5-methyl-1,3-oxazol-2-yl)phenyl]benzamide
CID 86938322

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dichlorophenyl)-4-ethoxy-3-methylbenzamide?
The IUPAC name of N-(2,6-dichlorophenyl)-4-ethoxy-3-methylbenzamide (CID 30147579) is N-(2,6-dichlorophenyl)-4-ethoxy-3-methylbenzamide.
What is the SMILES notation for N-(2,6-dichlorophenyl)-4-ethoxy-3-methylbenzamide?
The canonical SMILES for N-(2,6-dichlorophenyl)-4-ethoxy-3-methylbenzamide is CCOc1ccc(C(=O)Nc2c(Cl)cccc2Cl)cc1C.
What is the InChIKey of N-(2,6-dichlorophenyl)-4-ethoxy-3-methylbenzamide?
The InChIKey is VCOLHXUJNYLUKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15Cl2NO2/c1-3-21-14-8-7-11(9-10(14)2)16(20)19-15-12(17)5-4-6-13(15)18/h4-9H,3H2,1-2H3,(H,19,20).
What are the key properties of N-(2,6-dichlorophenyl)-4-ethoxy-3-methylbenzamide?
N-(2,6-dichlorophenyl)-4-ethoxy-3-methylbenzamide has a molecular weight of 324.21 g/mol, XLogP of 4.95, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dichlorophenyl)-4-ethoxy-3-methylbenzamide is sourced from PubChem (CID 30147579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).