N-(5-acetyl-2-methylphenyl)-2-(4-morpholin-4-ylphenyl)acetamide

C21H24N2O3 — CID 110425585

IUPACN-(5-acetyl-2-methylphenyl)-2-(4-morpholin-4-ylphenyl)acetamide
SMILESCC(=O)c1ccc(C)c(NC(=O)Cc2ccc(N3CCOCC3)cc2)c1
InChIInChI=1S/C21H24N2O3/c1-15-3-6-18(16(2)24)14-20(15)22-21(25)13-17-4-7-19(8-5-17)23-9-11-26-12-10-23/h3-8,14H,9-13H2,1-2H3,(H,22,25)
InChIKeyUIFVMTWKNLNQAX-UHFFFAOYSA-N
MW352.43 g/mol
LogP3.22
Rot. Bonds5

About N-(5-acetyl-2-methylphenyl)-2-(4-morpholin-4-ylphenyl)acetamide

N-(5-acetyl-2-methylphenyl)-2-(4-morpholin-4-ylphenyl)acetamide (PubChem CID 110425585) has the molecular formula C21H24N2O3 and a molecular weight of 352.43 g/mol. Its IUPAC name is N-(5-acetyl-2-methylphenyl)-2-(4-morpholin-4-ylphenyl)acetamide.

Molecular Properties

Compound NameN-(5-acetyl-2-methylphenyl)-2-(4-morpholin-4-ylphenyl)acetamide
PubChem CID110425585
Molecular FormulaC21H24N2O3
Molecular Weight352.43 g/mol
Exact Mass352.18
IUPAC NameN-(5-acetyl-2-methylphenyl)-2-(4-morpholin-4-ylphenyl)acetamide
SMILESCC(=O)c1ccc(C)c(NC(=O)Cc2ccc(N3CCOCC3)cc2)c1
InChIInChI=1S/C21H24N2O3/c1-15-3-6-18(16(2)24)14-20(15)22-21(25)13-17-4-7-19(8-5-17)23-9-11-26-12-10-23/h3-8,14H,9-13H2,1-2H3,(H,22,25)
InChIKeyUIFVMTWKNLNQAX-UHFFFAOYSA-N
XLogP3.22
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.43
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

Analyze N-(5-acetyl-2-methylphenyl)-2-(4-morpholin-4-ylphenyl)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

1-[4-[4-(4-morpholin-4-ylphenyl)piperazin-1-yl]phenyl]ethanone
CID 20729332
3-[[4-(diethylaminomethyl)benzoyl]amino]-4-methyl-N-(4-morpholin-4-ylphenyl)benzamide
CID 174437444
N-(2-bromophenyl)-2-(4-morpholin-4-ylphenyl)acetamide
CID 110425885
N-(4-acetylphenyl)-2-(4-pyrrolidin-1-ylphenyl)acetamide
CID 110409479
2-(4-morpholin-4-ylphenyl)-N-(2,3,4-trifluorophenyl)acetamide
CID 110428777
N-(3,4-dimethylphenyl)-3-(4-morpholin-4-ylphenyl)propanamide
CID 110649726
N-(4-chloro-2,5-dimethoxyphenyl)-2-(4-morpholin-4-ylphenyl)acetamide
CID 110427902
N-(2-methyl-5-morpholin-4-ylphenyl)-3-thiophen-2-ylpropanamide
CID 110362509
3-[[2-(4-chlorophenyl)acetyl]amino]-4-methylbenzoic acid
CID 893334
N-[4-(cyclopropanecarbonyl)phenyl]-2-(4-morpholin-4-ylphenyl)acetamide
CID 110612773
N-(2-fluoro-5-morpholin-4-ylphenyl)-2-phenylacetamide
CID 110362608
N-(4-acetamido-2-morpholin-4-ylphenyl)-2-(4-bromophenyl)acetamide
CID 30490824

Frequently Asked Questions

What is the IUPAC name of N-(5-acetyl-2-methylphenyl)-2-(4-morpholin-4-ylphenyl)acetamide?
The IUPAC name of N-(5-acetyl-2-methylphenyl)-2-(4-morpholin-4-ylphenyl)acetamide (CID 110425585) is N-(5-acetyl-2-methylphenyl)-2-(4-morpholin-4-ylphenyl)acetamide.
What is the SMILES notation for N-(5-acetyl-2-methylphenyl)-2-(4-morpholin-4-ylphenyl)acetamide?
The canonical SMILES for N-(5-acetyl-2-methylphenyl)-2-(4-morpholin-4-ylphenyl)acetamide is CC(=O)c1ccc(C)c(NC(=O)Cc2ccc(N3CCOCC3)cc2)c1.
What is the InChIKey of N-(5-acetyl-2-methylphenyl)-2-(4-morpholin-4-ylphenyl)acetamide?
The InChIKey is UIFVMTWKNLNQAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N2O3/c1-15-3-6-18(16(2)24)14-20(15)22-21(25)13-17-4-7-19(8-5-17)23-9-11-26-12-10-23/h3-8,14H,9-13H2,1-2H3,(H,22,25).
What are the key properties of N-(5-acetyl-2-methylphenyl)-2-(4-morpholin-4-ylphenyl)acetamide?
N-(5-acetyl-2-methylphenyl)-2-(4-morpholin-4-ylphenyl)acetamide has a molecular weight of 352.43 g/mol, XLogP of 3.22, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-acetyl-2-methylphenyl)-2-(4-morpholin-4-ylphenyl)acetamide is sourced from PubChem (CID 110425585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).