2-[[2-(2,4-dimethylphenoxy)acetyl]amino]-N-ethylbenzamide

C19H22N2O3 — CID 4949320

IUPAC2-[[2-(2,4-dimethylphenoxy)acetyl]amino]-N-ethylbenzamide
SMILESCCNC(=O)c1ccccc1NC(=O)COc1ccc(C)cc1C
InChIInChI=1S/C19H22N2O3/c1-4-20-19(23)15-7-5-6-8-16(15)21-18(22)12-24-17-10-9-13(2)11-14(17)3/h5-11H,4,12H2,1-3H3,(H,20,23)(H,21,22)
InChIKeyCZLQEYRVILBQFX-UHFFFAOYSA-N
MW326.40 g/mol
LogP3.07
Rot. Bonds6

About 2-[[2-(2,4-dimethylphenoxy)acetyl]amino]-N-ethylbenzamide

2-[[2-(2,4-dimethylphenoxy)acetyl]amino]-N-ethylbenzamide (PubChem CID 4949320) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is 2-[[2-(2,4-dimethylphenoxy)acetyl]amino]-N-ethylbenzamide.

Molecular Properties

Compound Name2-[[2-(2,4-dimethylphenoxy)acetyl]amino]-N-ethylbenzamide
PubChem CID4949320
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC Name2-[[2-(2,4-dimethylphenoxy)acetyl]amino]-N-ethylbenzamide
SMILESCCNC(=O)c1ccccc1NC(=O)COc1ccc(C)cc1C
InChIInChI=1S/C19H22N2O3/c1-4-20-19(23)15-7-5-6-8-16(15)21-18(22)12-24-17-10-9-13(2)11-14(17)3/h5-11H,4,12H2,1-3H3,(H,20,23)(H,21,22)
InChIKeyCZLQEYRVILBQFX-UHFFFAOYSA-N
XLogP3.07
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 53.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[2-(4-bromo-2-methylphenoxy)acetyl]amino]-N-ethylbenzamide
CID 4949446
N-(2-aminoethyl)-2-[[2-(2,4-dimethylphenoxy)acetyl]amino]benzamide;hydrochloride
CID 120603417
2-[[2-(2,4-dimethylphenoxy)acetyl]amino]benzoic acid
CID 45426301
2-[[2-(2,4-dimethylphenoxy)acetyl]amino]-N-(1-phenylethyl)benzamide
CID 4935075
2-[[2-(2,4-dibromophenoxy)acetyl]amino]-N-ethylbenzamide
CID 4949434
2-(2,4-dimethylphenoxy)-N-ethylacetamide
CID 965411
2-(2,4-dimethylphenoxy)-N-(2-sulfanylphenyl)acetamide
CID 23932880
2-[[2-(2-bromo-4-tert-butylphenoxy)acetyl]amino]-N-ethylbenzamide
CID 17350181
2-[[2-(2,5-dimethylphenoxy)acetyl]amino]-N-(2-phenylethyl)benzamide
CID 4929756
[2-[2-(cyclopropylcarbamoyl)anilino]-2-oxoethyl] 2-(2,4-dimethylphenoxy)acetate
CID 7815364
2-[[2-(4-bromo-2-methylphenoxy)acetyl]amino]-N-methylbenzamide
CID 17354006
N-(2-cyanophenyl)-2-(2,4-dimethylphenoxy)acetamide
CID 876328

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(2,4-dimethylphenoxy)acetyl]amino]-N-ethylbenzamide?
The IUPAC name of 2-[[2-(2,4-dimethylphenoxy)acetyl]amino]-N-ethylbenzamide (CID 4949320) is 2-[[2-(2,4-dimethylphenoxy)acetyl]amino]-N-ethylbenzamide.
What is the SMILES notation for 2-[[2-(2,4-dimethylphenoxy)acetyl]amino]-N-ethylbenzamide?
The canonical SMILES for 2-[[2-(2,4-dimethylphenoxy)acetyl]amino]-N-ethylbenzamide is CCNC(=O)c1ccccc1NC(=O)COc1ccc(C)cc1C.
What is the InChIKey of 2-[[2-(2,4-dimethylphenoxy)acetyl]amino]-N-ethylbenzamide?
The InChIKey is CZLQEYRVILBQFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O3/c1-4-20-19(23)15-7-5-6-8-16(15)21-18(22)12-24-17-10-9-13(2)11-14(17)3/h5-11H,4,12H2,1-3H3,(H,20,23)(H,21,22).
What are the key properties of 2-[[2-(2,4-dimethylphenoxy)acetyl]amino]-N-ethylbenzamide?
2-[[2-(2,4-dimethylphenoxy)acetyl]amino]-N-ethylbenzamide has a molecular weight of 326.40 g/mol, XLogP of 3.07, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(2,4-dimethylphenoxy)acetyl]amino]-N-ethylbenzamide is sourced from PubChem (CID 4949320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).