2-(N-acetyl-3-chloroanilino)-N-(2-morpholin-4-ylethyl)acetamide

C16H22ClN3O3 — CID 113171303

IUPAC2-(N-acetyl-3-chloroanilino)-N-(2-morpholin-4-ylethyl)acetamide
SMILESCC(=O)N(CC(=O)NCCN1CCOCC1)c1cccc(Cl)c1
InChIInChI=1S/C16H22ClN3O3/c1-13(21)20(15-4-2-3-14(17)11-15)12-16(22)18-5-6-19-7-9-23-10-8-19/h2-4,11H,5-10,12H2,1H3,(H,18,22)
InChIKeyLHGLGGJXDZACOD-UHFFFAOYSA-N
MW339.82 g/mol
LogP1.14
Rot. Bonds6

About 2-(N-acetyl-3-chloroanilino)-N-(2-morpholin-4-ylethyl)acetamide

2-(N-acetyl-3-chloroanilino)-N-(2-morpholin-4-ylethyl)acetamide (PubChem CID 113171303) has the molecular formula C16H22ClN3O3 and a molecular weight of 339.82 g/mol. Its IUPAC name is 2-(N-acetyl-3-chloroanilino)-N-(2-morpholin-4-ylethyl)acetamide.

Molecular Properties

Compound Name2-(N-acetyl-3-chloroanilino)-N-(2-morpholin-4-ylethyl)acetamide
PubChem CID113171303
Molecular FormulaC16H22ClN3O3
Molecular Weight339.82 g/mol
Exact Mass339.13
IUPAC Name2-(N-acetyl-3-chloroanilino)-N-(2-morpholin-4-ylethyl)acetamide
SMILESCC(=O)N(CC(=O)NCCN1CCOCC1)c1cccc(Cl)c1
InChIInChI=1S/C16H22ClN3O3/c1-13(21)20(15-4-2-3-14(17)11-15)12-16(22)18-5-6-19-7-9-23-10-8-19/h2-4,11H,5-10,12H2,1H3,(H,18,22)
InChIKeyLHGLGGJXDZACOD-UHFFFAOYSA-N
XLogP1.14
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.82
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(N-acetyl-3-chloroanilino)-N-(2-morpholin-4-ylethyl)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

3-(N-acetyl-3-chloroanilino)-N-(2-morpholin-4-ylethyl)propanamide
CID 113127193
2-(N-acetyl-4-bromo-3-methylanilino)-N-(2-morpholin-4-ylethyl)acetamide
CID 113178152
2-(N-acetyl-2,6-difluoroanilino)-N-(2-morpholin-4-ylethyl)acetamide
CID 113181389
methyl 4-[acetyl-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]amino]benzoate
CID 113176363
2-(N-acetyl-3-chloroanilino)-N-(2-methylpropyl)acetamide
CID 113171290
methyl 2-[acetyl-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]amino]benzoate
CID 113176051
3-chloro-N-(2-morpholin-4-ylethyl)benzamide
CID 669179
2-[2-(3-chlorophenyl)ethylamino]-N-(2-morpholin-4-ylethyl)acetamide
CID 108994936
N'-ethyl-N'-(3-methylphenyl)-N-(2-morpholin-4-ylethyl)propanediamide
CID 108944137
N-(3-chlorophenyl)-N-(3-morpholin-4-yl-3-oxopropyl)acetamide
CID 113127190
2-(3-methyl-N-methylsulfonylanilino)-N-(2-morpholin-4-ylethyl)acetamide
CID 6493657
3-(N-acetyl-2,6-difluoroanilino)-N-(2-morpholin-4-ylethyl)propanamide
CID 113135341

Frequently Asked Questions

What is the IUPAC name of 2-(N-acetyl-3-chloroanilino)-N-(2-morpholin-4-ylethyl)acetamide?
The IUPAC name of 2-(N-acetyl-3-chloroanilino)-N-(2-morpholin-4-ylethyl)acetamide (CID 113171303) is 2-(N-acetyl-3-chloroanilino)-N-(2-morpholin-4-ylethyl)acetamide.
What is the SMILES notation for 2-(N-acetyl-3-chloroanilino)-N-(2-morpholin-4-ylethyl)acetamide?
The canonical SMILES for 2-(N-acetyl-3-chloroanilino)-N-(2-morpholin-4-ylethyl)acetamide is CC(=O)N(CC(=O)NCCN1CCOCC1)c1cccc(Cl)c1.
What is the InChIKey of 2-(N-acetyl-3-chloroanilino)-N-(2-morpholin-4-ylethyl)acetamide?
The InChIKey is LHGLGGJXDZACOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22ClN3O3/c1-13(21)20(15-4-2-3-14(17)11-15)12-16(22)18-5-6-19-7-9-23-10-8-19/h2-4,11H,5-10,12H2,1H3,(H,18,22).
What are the key properties of 2-(N-acetyl-3-chloroanilino)-N-(2-morpholin-4-ylethyl)acetamide?
2-(N-acetyl-3-chloroanilino)-N-(2-morpholin-4-ylethyl)acetamide has a molecular weight of 339.82 g/mol, XLogP of 1.14, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-acetyl-3-chloroanilino)-N-(2-morpholin-4-ylethyl)acetamide is sourced from PubChem (CID 113171303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).