N-(4-acetylphenyl)-2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]acetamide

C22H27N3O3 — CID 2127262

IUPACN-(4-acetylphenyl)-2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]acetamide
SMILESCCCN(CC(=O)Nc1ccc(C(C)=O)cc1)CC(=O)Nc1ccccc1C
InChIInChI=1S/C22H27N3O3/c1-4-13-25(15-22(28)24-20-8-6-5-7-16(20)2)14-21(27)23-19-11-9-18(10-12-19)17(3)26/h5-12H,4,13-15H2,1-3H3,(H,23,27)(H,24,28)
InChIKeyJIQXZNSCZGOIFO-UHFFFAOYSA-N
MW381.48 g/mol
LogP3.49
Rot. Bonds9

About N-(4-acetylphenyl)-2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]acetamide

N-(4-acetylphenyl)-2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]acetamide (PubChem CID 2127262) has the molecular formula C22H27N3O3 and a molecular weight of 381.48 g/mol. Its IUPAC name is N-(4-acetylphenyl)-2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]acetamide.

Molecular Properties

Compound NameN-(4-acetylphenyl)-2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]acetamide
PubChem CID2127262
Molecular FormulaC22H27N3O3
Molecular Weight381.48 g/mol
Exact Mass381.21
IUPAC NameN-(4-acetylphenyl)-2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]acetamide
SMILESCCCN(CC(=O)Nc1ccc(C(C)=O)cc1)CC(=O)Nc1ccccc1C
InChIInChI=1S/C22H27N3O3/c1-4-13-25(15-22(28)24-20-8-6-5-7-16(20)2)14-21(27)23-19-11-9-18(10-12-19)17(3)26/h5-12H,4,13-15H2,1-3H3,(H,23,27)(H,24,28)
InChIKeyJIQXZNSCZGOIFO-UHFFFAOYSA-N
XLogP3.49
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.48
LogP ≤ 53.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(4-acetylphenyl)-2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]acetamide 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

Procainamide
CID 4913
Trichostatin A
CID 444732
N-Acetylprocainamide
CID 4342
Procainamide Hydrochloride
CID 66068
4,4'-Bis(dimethylamino)benzophenone
CID 7031
Tacedinaline
CID 2746
Balicatib
CID 10201696
Ameltolide
CID 13086
Mozavaptan
CID 119369
Ar-42
CID 6918848
Dinaline
CID 42725
Acecainide Hydrochloride
CID 71417

Frequently Asked Questions

What is the IUPAC name of N-(4-acetylphenyl)-2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]acetamide?
The IUPAC name of N-(4-acetylphenyl)-2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]acetamide (CID 2127262) is N-(4-acetylphenyl)-2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]acetamide.
What is the SMILES notation for N-(4-acetylphenyl)-2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]acetamide?
The canonical SMILES for N-(4-acetylphenyl)-2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]acetamide is CCCN(CC(=O)Nc1ccc(C(C)=O)cc1)CC(=O)Nc1ccccc1C.
What is the InChIKey of N-(4-acetylphenyl)-2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]acetamide?
The InChIKey is JIQXZNSCZGOIFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27N3O3/c1-4-13-25(15-22(28)24-20-8-6-5-7-16(20)2)14-21(27)23-19-11-9-18(10-12-19)17(3)26/h5-12H,4,13-15H2,1-3H3,(H,23,27)(H,24,28).
What are the key properties of N-(4-acetylphenyl)-2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]acetamide?
N-(4-acetylphenyl)-2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]acetamide has a molecular weight of 381.48 g/mol, XLogP of 3.49, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetylphenyl)-2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]acetamide is sourced from PubChem (CID 2127262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).