2-[2-[1-(2,4-dichlorophenyl)ethylamino]-2-oxoethoxy]benzamide

C17H16Cl2N2O3 — CID 4884296

IUPAC2-[2-[1-(2,4-dichlorophenyl)ethylamino]-2-oxoethoxy]benzamide
SMILESCC(NC(=O)COc1ccccc1C(N)=O)c1ccc(Cl)cc1Cl
InChIInChI=1S/C17H16Cl2N2O3/c1-10(12-7-6-11(18)8-14(12)19)21-16(22)9-24-15-5-3-2-4-13(15)17(20)23/h2-8,10H,9H2,1H3,(H2,20,23)(H,21,22)
InChIKeyAORRQCMUEZUQPT-UHFFFAOYSA-N
MW367.23 g/mol
LogP3.35
Rot. Bonds6

About 2-[2-[1-(2,4-dichlorophenyl)ethylamino]-2-oxoethoxy]benzamide

2-[2-[1-(2,4-dichlorophenyl)ethylamino]-2-oxoethoxy]benzamide (PubChem CID 4884296) has the molecular formula C17H16Cl2N2O3 and a molecular weight of 367.23 g/mol. Its IUPAC name is 2-[2-[1-(2,4-dichlorophenyl)ethylamino]-2-oxoethoxy]benzamide.

Molecular Properties

Compound Name2-[2-[1-(2,4-dichlorophenyl)ethylamino]-2-oxoethoxy]benzamide
PubChem CID4884296
Molecular FormulaC17H16Cl2N2O3
Molecular Weight367.23 g/mol
Exact Mass366.05
IUPAC Name2-[2-[1-(2,4-dichlorophenyl)ethylamino]-2-oxoethoxy]benzamide
SMILESCC(NC(=O)COc1ccccc1C(N)=O)c1ccc(Cl)cc1Cl
InChIInChI=1S/C17H16Cl2N2O3/c1-10(12-7-6-11(18)8-14(12)19)21-16(22)9-24-15-5-3-2-4-13(15)17(20)23/h2-8,10H,9H2,1H3,(H2,20,23)(H,21,22)
InChIKeyAORRQCMUEZUQPT-UHFFFAOYSA-N
XLogP3.35
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.23
LogP ≤ 53.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]-2-oxoethoxy]benzamide
CID 7199656
[2-[1-(2,4-dichlorophenyl)ethylamino]-2-oxoethyl] 2-(2-chlorophenoxy)acetate
CID 42978732
N-[(1R)-1-(2,4-dichlorophenyl)ethyl]-2-(2-nitrophenoxy)acetamide
CID 2500589
N-[(1S)-1-(2,4-dichlorophenyl)ethyl]-2-(2-nitrophenoxy)acetamide
CID 2500586
N-[(1R)-1-(2-chlorophenyl)ethyl]-2-(2,4-dichlorophenoxy)acetamide
CID 7859030
2-[2-[[(1R)-1-(2-bromophenyl)ethyl]amino]-2-oxoethoxy]benzamide
CID 9090585
2-[2-oxo-2-[[(1R)-1-phenylethyl]amino]ethoxy]benzamide
CID 8866061
2-[2-[[(S)-(4-chlorophenyl)-phenylmethyl]amino]-2-oxoethoxy]benzamide
CID 8851691
[2-[[(1R)-1-(2,4-dichlorophenyl)ethyl]amino]-2-oxoethyl] 2-chloropyridine-3-carboxylate
CID 2515658
N-[(1S)-1-(2,4-dichlorophenyl)ethyl]-2-[(2-nitro-3-pyridinyl)oxy]acetamide
CID 40551951
N-[1-(2,4-dichlorophenyl)ethyl]-2-quinazolin-4-yloxyacetamide
CID 4879244
[2-[[(1S)-1-(2,4-dichlorophenyl)ethyl]amino]-2-oxoethyl] (2R)-2-hydroxy-2-phenylacetate
CID 7834173

Frequently Asked Questions

What is the IUPAC name of 2-[2-[1-(2,4-dichlorophenyl)ethylamino]-2-oxoethoxy]benzamide?
The IUPAC name of 2-[2-[1-(2,4-dichlorophenyl)ethylamino]-2-oxoethoxy]benzamide (CID 4884296) is 2-[2-[1-(2,4-dichlorophenyl)ethylamino]-2-oxoethoxy]benzamide.
What is the SMILES notation for 2-[2-[1-(2,4-dichlorophenyl)ethylamino]-2-oxoethoxy]benzamide?
The canonical SMILES for 2-[2-[1-(2,4-dichlorophenyl)ethylamino]-2-oxoethoxy]benzamide is CC(NC(=O)COc1ccccc1C(N)=O)c1ccc(Cl)cc1Cl.
What is the InChIKey of 2-[2-[1-(2,4-dichlorophenyl)ethylamino]-2-oxoethoxy]benzamide?
The InChIKey is AORRQCMUEZUQPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16Cl2N2O3/c1-10(12-7-6-11(18)8-14(12)19)21-16(22)9-24-15-5-3-2-4-13(15)17(20)23/h2-8,10H,9H2,1H3,(H2,20,23)(H,21,22).
What are the key properties of 2-[2-[1-(2,4-dichlorophenyl)ethylamino]-2-oxoethoxy]benzamide?
2-[2-[1-(2,4-dichlorophenyl)ethylamino]-2-oxoethoxy]benzamide has a molecular weight of 367.23 g/mol, XLogP of 3.35, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[1-(2,4-dichlorophenyl)ethylamino]-2-oxoethoxy]benzamide is sourced from PubChem (CID 4884296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).