2,4-dichloro-N-[2-(2,3-dimethylanilino)-2-oxoethyl]benzamide

C17H16Cl2N2O2 — CID 9342302

IUPAC2,4-dichloro-N-[2-(2,3-dimethylanilino)-2-oxoethyl]benzamide
SMILESCc1cccc(NC(=O)CNC(=O)c2ccc(Cl)cc2Cl)c1C
InChIInChI=1S/C17H16Cl2N2O2/c1-10-4-3-5-15(11(10)2)21-16(22)9-20-17(23)13-7-6-12(18)8-14(13)19/h3-8H,9H2,1-2H3,(H,20,23)(H,21,22)
InChIKeyFODNSODKZVFDCK-UHFFFAOYSA-N
MW351.23 g/mol
LogP3.98
Rot. Bonds4

About 2,4-dichloro-N-[2-(2,3-dimethylanilino)-2-oxoethyl]benzamide

2,4-dichloro-N-[2-(2,3-dimethylanilino)-2-oxoethyl]benzamide (PubChem CID 9342302) has the molecular formula C17H16Cl2N2O2 and a molecular weight of 351.23 g/mol. Its IUPAC name is 2,4-dichloro-N-[2-(2,3-dimethylanilino)-2-oxoethyl]benzamide.

Molecular Properties

Compound Name2,4-dichloro-N-[2-(2,3-dimethylanilino)-2-oxoethyl]benzamide
PubChem CID9342302
Molecular FormulaC17H16Cl2N2O2
Molecular Weight351.23 g/mol
Exact Mass350.06
IUPAC Name2,4-dichloro-N-[2-(2,3-dimethylanilino)-2-oxoethyl]benzamide
SMILESCc1cccc(NC(=O)CNC(=O)c2ccc(Cl)cc2Cl)c1C
InChIInChI=1S/C17H16Cl2N2O2/c1-10-4-3-5-15(11(10)2)21-16(22)9-20-17(23)13-7-6-12(18)8-14(13)19/h3-8H,9H2,1-2H3,(H,20,23)(H,21,22)
InChIKeyFODNSODKZVFDCK-UHFFFAOYSA-N
XLogP3.98
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.23
LogP ≤ 53.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2,4-dichloro-N-[2-[2-[(2,3-dimethylphenyl)carbamothioyl]hydrazinyl]-2-oxoethyl]benzamide
CID 35780060
2,4-dichloro-N-[2-[[2-(2,3-dimethylanilino)-2-oxoethyl]-methylamino]-2-oxoethyl]benzamide
CID 27808106
2,4-dichloro-N-[2-(naphthalen-1-ylamino)-2-oxoethyl]benzamide
CID 24637845
N-[2-(2,3-dimethylanilino)-2-oxoethyl]-2,5-difluorobenzamide
CID 24681848
N-[2-(2,3-dimethylanilino)-2-oxoethyl]-2,4-difluorobenzamide
CID 26661170
2,4-dichloro-N-[2-[[2-(5-fluoro-2-methylanilino)-2-oxoethyl]amino]-2-oxoethyl]benzamide
CID 2604241
3-(2,4-dichlorophenyl)-N-(2,3-dimethylphenyl)propanamide
CID 100605551
2,4-dichloro-N-[2-[1-(2-methylphenyl)ethylamino]-2-oxoethyl]benzamide
CID 51164454
2,4-dichloro-N-[2-[[2-(2,6-dimethylanilino)-2-oxoethyl]-methylamino]-2-oxoethyl]benzamide
CID 27788350
N-[2-(4-bromo-3-methylanilino)-2-oxoethyl]-2,4-dichlorobenzamide
CID 24599976
N-(4-chloro-2-methylphenyl)-2-(2,3-dimethylanilino)acetamide
CID 7636870
[2-[[2-(2,3-dimethylanilino)-2-oxoethyl]amino]-2-oxoethyl] 2-chloro-4,5-difluorobenzoate
CID 7382611

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-N-[2-(2,3-dimethylanilino)-2-oxoethyl]benzamide?
The IUPAC name of 2,4-dichloro-N-[2-(2,3-dimethylanilino)-2-oxoethyl]benzamide (CID 9342302) is 2,4-dichloro-N-[2-(2,3-dimethylanilino)-2-oxoethyl]benzamide.
What is the SMILES notation for 2,4-dichloro-N-[2-(2,3-dimethylanilino)-2-oxoethyl]benzamide?
The canonical SMILES for 2,4-dichloro-N-[2-(2,3-dimethylanilino)-2-oxoethyl]benzamide is Cc1cccc(NC(=O)CNC(=O)c2ccc(Cl)cc2Cl)c1C.
What is the InChIKey of 2,4-dichloro-N-[2-(2,3-dimethylanilino)-2-oxoethyl]benzamide?
The InChIKey is FODNSODKZVFDCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16Cl2N2O2/c1-10-4-3-5-15(11(10)2)21-16(22)9-20-17(23)13-7-6-12(18)8-14(13)19/h3-8H,9H2,1-2H3,(H,20,23)(H,21,22).
What are the key properties of 2,4-dichloro-N-[2-(2,3-dimethylanilino)-2-oxoethyl]benzamide?
2,4-dichloro-N-[2-(2,3-dimethylanilino)-2-oxoethyl]benzamide has a molecular weight of 351.23 g/mol, XLogP of 3.98, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-N-[2-(2,3-dimethylanilino)-2-oxoethyl]benzamide is sourced from PubChem (CID 9342302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).