[2-[4-(dimethylcarbamoyl)anilino]-2-oxoethyl] 2-methylpropanoate

C15H20N2O4 — CID 7782647

IUPAC[2-[4-(dimethylcarbamoyl)anilino]-2-oxoethyl] 2-methylpropanoate
SMILESCC(C)C(=O)OCC(=O)Nc1ccc(C(=O)N(C)C)cc1
InChIInChI=1S/C15H20N2O4/c1-10(2)15(20)21-9-13(18)16-12-7-5-11(6-8-12)14(19)17(3)4/h5-8,10H,9H2,1-4H3,(H,16,18)
InChIKeyGRXYOUFWXKYANH-UHFFFAOYSA-N
MW292.34 g/mol
LogP1.53
Rot. Bonds5

About [2-[4-(dimethylcarbamoyl)anilino]-2-oxoethyl] 2-methylpropanoate

[2-[4-(dimethylcarbamoyl)anilino]-2-oxoethyl] 2-methylpropanoate (PubChem CID 7782647) has the molecular formula C15H20N2O4 and a molecular weight of 292.34 g/mol. Its IUPAC name is [2-[4-(dimethylcarbamoyl)anilino]-2-oxoethyl] 2-methylpropanoate.

Molecular Properties

Compound Name[2-[4-(dimethylcarbamoyl)anilino]-2-oxoethyl] 2-methylpropanoate
PubChem CID7782647
Molecular FormulaC15H20N2O4
Molecular Weight292.34 g/mol
Exact Mass292.14
IUPAC Name[2-[4-(dimethylcarbamoyl)anilino]-2-oxoethyl] 2-methylpropanoate
SMILESCC(C)C(=O)OCC(=O)Nc1ccc(C(=O)N(C)C)cc1
InChIInChI=1S/C15H20N2O4/c1-10(2)15(20)21-9-13(18)16-12-7-5-11(6-8-12)14(19)17(3)4/h5-8,10H,9H2,1-4H3,(H,16,18)
InChIKeyGRXYOUFWXKYANH-UHFFFAOYSA-N
XLogP1.53
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [2-[4-(dimethylcarbamoyl)anilino]-2-oxoethyl] 2-methylpropanoate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[2-[4-(dimethylcarbamoyl)anilino]-2-oxoethyl] (2R)-2-(4-chlorophenyl)-3-methylbutanoate
CID 7133428
[2-[4-(dimethylcarbamoyl)anilino]-2-oxoethyl] (2S)-2-(4-chlorophenyl)-3-methylbutanoate
CID 7133427
[2-[4-(dimethylcarbamoyl)anilino]-2-oxoethyl] (2S)-2-(phenylcarbamoylamino)propanoate
CID 8887651
[2-[4-(dimethylcarbamoyl)anilino]-2-oxoethyl] 4-(2-methylpropyl)benzoate
CID 8538268
[2-[4-(dimethylcarbamoyl)anilino]-2-oxoethyl] (2R)-2-(4-chlorophenyl)sulfanylpropanoate
CID 7821284
N,N'-bis[4-(dimethylcarbamoyl)phenyl]propanediamide
CID 17368155
[2-[4-(dimethylcarbamoyl)anilino]-2-oxoethyl] 2-(4-hydroxyphenyl)acetate
CID 8672080
[2-[4-(dimethylcarbamoyl)anilino]-2-oxoethyl] 4-(2-methylpropoxy)benzoate
CID 7194340
N,N-dimethyl-4-(3-methylbutanoylamino)benzamide
CID 38105549
4-[[2-(2-aminoethoxy)acetyl]amino]-N,N-dimethylbenzamide
CID 79474171
[2-[4-(dimethylcarbamoyl)anilino]-2-oxoethyl] 2-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)propanoate
CID 55324130
[2-[4-(dimethylcarbamoyl)anilino]-2-oxoethyl] 4-methylsulfonylbenzoate
CID 7752504

Frequently Asked Questions

What is the IUPAC name of [2-[4-(dimethylcarbamoyl)anilino]-2-oxoethyl] 2-methylpropanoate?
The IUPAC name of [2-[4-(dimethylcarbamoyl)anilino]-2-oxoethyl] 2-methylpropanoate (CID 7782647) is [2-[4-(dimethylcarbamoyl)anilino]-2-oxoethyl] 2-methylpropanoate.
What is the SMILES notation for [2-[4-(dimethylcarbamoyl)anilino]-2-oxoethyl] 2-methylpropanoate?
The canonical SMILES for [2-[4-(dimethylcarbamoyl)anilino]-2-oxoethyl] 2-methylpropanoate is CC(C)C(=O)OCC(=O)Nc1ccc(C(=O)N(C)C)cc1.
What is the InChIKey of [2-[4-(dimethylcarbamoyl)anilino]-2-oxoethyl] 2-methylpropanoate?
The InChIKey is GRXYOUFWXKYANH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O4/c1-10(2)15(20)21-9-13(18)16-12-7-5-11(6-8-12)14(19)17(3)4/h5-8,10H,9H2,1-4H3,(H,16,18).
What are the key properties of [2-[4-(dimethylcarbamoyl)anilino]-2-oxoethyl] 2-methylpropanoate?
[2-[4-(dimethylcarbamoyl)anilino]-2-oxoethyl] 2-methylpropanoate has a molecular weight of 292.34 g/mol, XLogP of 1.53, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[4-(dimethylcarbamoyl)anilino]-2-oxoethyl] 2-methylpropanoate is sourced from PubChem (CID 7782647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).