2,3-dichloro-4-ethylbenzamide

C9H9Cl2NO — CID 67592769

IUPAC2,3-dichloro-4-ethylbenzamide
SMILESCCc1ccc(C(N)=O)c(Cl)c1Cl
InChIInChI=1S/C9H9Cl2NO/c1-2-5-3-4-6(9(12)13)8(11)7(5)10/h3-4H,2H2,1H3,(H2,12,13)
InChIKeyKENAWQCVTVISMZ-UHFFFAOYSA-N
MW218.08 g/mol
LogP2.65
Rot. Bonds2

About 2,3-dichloro-4-ethylbenzamide

2,3-dichloro-4-ethylbenzamide (PubChem CID 67592769) has the molecular formula C9H9Cl2NO and a molecular weight of 218.08 g/mol. Its IUPAC name is 2,3-dichloro-4-ethylbenzamide.

Molecular Properties

Compound Name2,3-dichloro-4-ethylbenzamide
PubChem CID67592769
Molecular FormulaC9H9Cl2NO
Molecular Weight218.08 g/mol
Exact Mass217.01
IUPAC Name2,3-dichloro-4-ethylbenzamide
SMILESCCc1ccc(C(N)=O)c(Cl)c1Cl
InChIInChI=1S/C9H9Cl2NO/c1-2-5-3-4-6(9(12)13)8(11)7(5)10/h3-4H,2H2,1H3,(H2,12,13)
InChIKeyKENAWQCVTVISMZ-UHFFFAOYSA-N
XLogP2.65
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.08
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-chloro-4-methyl-2-propylbenzamide
CID 141280601
2-amino-3-chloro-4-(diethylphosphorylmethyl)benzamide
CID 141058944
2-(3-carbamoyl-2-chlorophenyl)acetic acid
CID 71239300
3-(1-amino-1-oxobutan-2-yl)-2-chloro-4-fluorobenzamide
CID 91612767
3,4-dibutylbenzene-1,2-dicarboxamide
CID 175393546
4-ethyl-2-hydroxy-3-(4-hydroxyphenyl)benzamide
CID 174769014
ethyl 4-benzyl-2,3-dichlorobenzoate
CID 70381316
2,3-diethylbenzamide;hydrofluoride
CID 175203586
2-chloro-4-(4,5-dihydro-1H-imidazol-2-ylmethyl)-3-methylbenzamide
CID 69269725
2-chloro-4-fluoro-3-methoxybenzamide
CID 163198226
2-fluoro-4-propylbenzamide
CID 175786906
4,6-dihexylbenzene-1,3-dicarboxamide
CID 140600774

Frequently Asked Questions

What is the IUPAC name of 2,3-dichloro-4-ethylbenzamide?
The IUPAC name of 2,3-dichloro-4-ethylbenzamide (CID 67592769) is 2,3-dichloro-4-ethylbenzamide.
What is the SMILES notation for 2,3-dichloro-4-ethylbenzamide?
The canonical SMILES for 2,3-dichloro-4-ethylbenzamide is CCc1ccc(C(N)=O)c(Cl)c1Cl.
What is the InChIKey of 2,3-dichloro-4-ethylbenzamide?
The InChIKey is KENAWQCVTVISMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9Cl2NO/c1-2-5-3-4-6(9(12)13)8(11)7(5)10/h3-4H,2H2,1H3,(H2,12,13).
What are the key properties of 2,3-dichloro-4-ethylbenzamide?
2,3-dichloro-4-ethylbenzamide has a molecular weight of 218.08 g/mol, XLogP of 2.65, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dichloro-4-ethylbenzamide is sourced from PubChem (CID 67592769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).