N-[2-(4-acetamidoanilino)-2-oxoethyl]-N-ethylbenzamide

C19H21N3O3 — CID 18077820

IUPACN-[2-(4-acetamidoanilino)-2-oxoethyl]-N-ethylbenzamide
SMILESCCN(CC(=O)Nc1ccc(NC(C)=O)cc1)C(=O)c1ccccc1
InChIInChI=1S/C19H21N3O3/c1-3-22(19(25)15-7-5-4-6-8-15)13-18(24)21-17-11-9-16(10-12-17)20-14(2)23/h4-12H,3,13H2,1-2H3,(H,20,23)(H,21,24)
InChIKeyIEUPPOCARRSHFV-UHFFFAOYSA-N
MW339.40 g/mol
LogP2.75
Rot. Bonds6

About N-[2-(4-acetamidoanilino)-2-oxoethyl]-N-ethylbenzamide

N-[2-(4-acetamidoanilino)-2-oxoethyl]-N-ethylbenzamide (PubChem CID 18077820) has the molecular formula C19H21N3O3 and a molecular weight of 339.40 g/mol. Its IUPAC name is N-[2-(4-acetamidoanilino)-2-oxoethyl]-N-ethylbenzamide.

Molecular Properties

Compound NameN-[2-(4-acetamidoanilino)-2-oxoethyl]-N-ethylbenzamide
PubChem CID18077820
Molecular FormulaC19H21N3O3
Molecular Weight339.40 g/mol
Exact Mass339.16
IUPAC NameN-[2-(4-acetamidoanilino)-2-oxoethyl]-N-ethylbenzamide
SMILESCCN(CC(=O)Nc1ccc(NC(C)=O)cc1)C(=O)c1ccccc1
InChIInChI=1S/C19H21N3O3/c1-3-22(19(25)15-7-5-4-6-8-15)13-18(24)21-17-11-9-16(10-12-17)20-14(2)23/h4-12H,3,13H2,1-2H3,(H,20,23)(H,21,24)
InChIKeyIEUPPOCARRSHFV-UHFFFAOYSA-N
XLogP2.75
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.40
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(4-acetamidoanilino)-2-oxoethyl]-4-(1,3-dioxoisoindol-2-yl)-N-ethylbenzamide
CID 25162408
4-acetamido-N-ethyl-N-(2-methylprop-2-enyl)benzamide
CID 37012021
4-[[2-(dimethylamino)acetyl]amino]-N,N-diethylbenzamide
CID 54843896
(E)-N-[2-(4-acetamidoanilino)-2-oxoethyl]-N-ethyl-3-phenylprop-2-enamide
CID 18077818
N-(4-acetamidophenyl)-2-[[2-(4-benzoylphenoxy)acetyl]-ethylamino]acetamide
CID 4968357
N-benzyl-N-ethyl-4-(propanoylamino)benzamide
CID 17257316
1-N-(4-acetamidophenyl)-4-N,4-N-diethylbenzene-1,4-dicarboxamide
CID 109048426
3-acetamido-N-[2-(tert-butylamino)-2-oxoethyl]-N-ethylbenzamide
CID 51172752
methyl 2-[benzoyl(ethyl)amino]acetate
CID 57002755
[2-[4-(diethylcarbamoyl)anilino]-2-oxoethyl] 4-acetamidobenzoate
CID 7957923
N-(4-acetamidophenyl)-2-[acetyl(2-phenylethyl)amino]acetamide
CID 113164087
CID 174412487
CID 174412487

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-acetamidoanilino)-2-oxoethyl]-N-ethylbenzamide?
The IUPAC name of N-[2-(4-acetamidoanilino)-2-oxoethyl]-N-ethylbenzamide (CID 18077820) is N-[2-(4-acetamidoanilino)-2-oxoethyl]-N-ethylbenzamide.
What is the SMILES notation for N-[2-(4-acetamidoanilino)-2-oxoethyl]-N-ethylbenzamide?
The canonical SMILES for N-[2-(4-acetamidoanilino)-2-oxoethyl]-N-ethylbenzamide is CCN(CC(=O)Nc1ccc(NC(C)=O)cc1)C(=O)c1ccccc1.
What is the InChIKey of N-[2-(4-acetamidoanilino)-2-oxoethyl]-N-ethylbenzamide?
The InChIKey is IEUPPOCARRSHFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O3/c1-3-22(19(25)15-7-5-4-6-8-15)13-18(24)21-17-11-9-16(10-12-17)20-14(2)23/h4-12H,3,13H2,1-2H3,(H,20,23)(H,21,24).
What are the key properties of N-[2-(4-acetamidoanilino)-2-oxoethyl]-N-ethylbenzamide?
N-[2-(4-acetamidoanilino)-2-oxoethyl]-N-ethylbenzamide has a molecular weight of 339.40 g/mol, XLogP of 2.75, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-acetamidoanilino)-2-oxoethyl]-N-ethylbenzamide is sourced from PubChem (CID 18077820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).