2-[1-(2-chlorophenyl)ethylamino]-N-(4-morpholin-4-ylphenyl)propanamide

C21H26ClN3O2 — CID 51168773

IUPAC2-[1-(2-chlorophenyl)ethylamino]-N-(4-morpholin-4-ylphenyl)propanamide
SMILESCC(NC(C)c1ccccc1Cl)C(=O)Nc1ccc(N2CCOCC2)cc1
InChIInChI=1S/C21H26ClN3O2/c1-15(19-5-3-4-6-20(19)22)23-16(2)21(26)24-17-7-9-18(10-8-17)25-11-13-27-14-12-25/h3-10,15-16,23H,11-14H2,1-2H3,(H,24,26)
InChIKeyUWHUOKUUPYAVTH-UHFFFAOYSA-N
MW387.91 g/mol
LogP3.85
Rot. Bonds6

About 2-[1-(2-chlorophenyl)ethylamino]-N-(4-morpholin-4-ylphenyl)propanamide

2-[1-(2-chlorophenyl)ethylamino]-N-(4-morpholin-4-ylphenyl)propanamide (PubChem CID 51168773) has the molecular formula C21H26ClN3O2 and a molecular weight of 387.91 g/mol. Its IUPAC name is 2-[1-(2-chlorophenyl)ethylamino]-N-(4-morpholin-4-ylphenyl)propanamide.

Molecular Properties

Compound Name2-[1-(2-chlorophenyl)ethylamino]-N-(4-morpholin-4-ylphenyl)propanamide
PubChem CID51168773
Molecular FormulaC21H26ClN3O2
Molecular Weight387.91 g/mol
Exact Mass387.17
IUPAC Name2-[1-(2-chlorophenyl)ethylamino]-N-(4-morpholin-4-ylphenyl)propanamide
SMILESCC(NC(C)c1ccccc1Cl)C(=O)Nc1ccc(N2CCOCC2)cc1
InChIInChI=1S/C21H26ClN3O2/c1-15(19-5-3-4-6-20(19)22)23-16(2)21(26)24-17-7-9-18(10-8-17)25-11-13-27-14-12-25/h3-10,15-16,23H,11-14H2,1-2H3,(H,24,26)
InChIKeyUWHUOKUUPYAVTH-UHFFFAOYSA-N
XLogP3.85
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.91
LogP ≤ 53.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

Analyze 2-[1-(2-chlorophenyl)ethylamino]-N-(4-morpholin-4-ylphenyl)propanamide 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-[1-(2-chlorophenyl)ethylamino]-N-(4-piperidin-1-ylsulfonylphenyl)propanamide
CID 55352204
[1-(4-morpholin-4-ylanilino)-1-oxopropan-2-yl] 2-chlorobenzoate
CID 55318916
(2S)-N-(4-morpholin-4-ylphenyl)-2-(4-phenylanilino)propanamide
CID 7509574
(2S)-N-(4-morpholin-4-ylphenyl)-2-[[(S)-phenyl(thiophen-2-yl)methyl]amino]propanamide
CID 9030001
(2R)-2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]-N-methylpropanamide
CID 9410224
(2R)-2-(2-methylpyridin-1-ium-1-yl)-N-(4-morpholin-4-ylphenyl)propanamide
CID 8717770
2-amino-N-(4-morpholin-4-ylphenyl)propanamide
CID 60638930
(2R)-N-tert-butyl-2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]propanamide
CID 51925554
(2R)-N-(4-morpholin-4-ylphenyl)-2-phenylsulfanylpropanamide
CID 2079704
2-[1-(2-fluorophenyl)ethylsulfanyl]-N-(4-morpholin-4-ylphenyl)propanamide
CID 49154044
N-[1-(2-chlorophenyl)ethyl]-4-pyrrolidin-1-ylaniline
CID 43226933
(2S)-2-(cyclohexylamino)-N-(4-morpholin-4-ylphenyl)propanamide
CID 7928372

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-chlorophenyl)ethylamino]-N-(4-morpholin-4-ylphenyl)propanamide?
The IUPAC name of 2-[1-(2-chlorophenyl)ethylamino]-N-(4-morpholin-4-ylphenyl)propanamide (CID 51168773) is 2-[1-(2-chlorophenyl)ethylamino]-N-(4-morpholin-4-ylphenyl)propanamide.
What is the SMILES notation for 2-[1-(2-chlorophenyl)ethylamino]-N-(4-morpholin-4-ylphenyl)propanamide?
The canonical SMILES for 2-[1-(2-chlorophenyl)ethylamino]-N-(4-morpholin-4-ylphenyl)propanamide is CC(NC(C)c1ccccc1Cl)C(=O)Nc1ccc(N2CCOCC2)cc1.
What is the InChIKey of 2-[1-(2-chlorophenyl)ethylamino]-N-(4-morpholin-4-ylphenyl)propanamide?
The InChIKey is UWHUOKUUPYAVTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26ClN3O2/c1-15(19-5-3-4-6-20(19)22)23-16(2)21(26)24-17-7-9-18(10-8-17)25-11-13-27-14-12-25/h3-10,15-16,23H,11-14H2,1-2H3,(H,24,26).
What are the key properties of 2-[1-(2-chlorophenyl)ethylamino]-N-(4-morpholin-4-ylphenyl)propanamide?
2-[1-(2-chlorophenyl)ethylamino]-N-(4-morpholin-4-ylphenyl)propanamide has a molecular weight of 387.91 g/mol, XLogP of 3.85, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-chlorophenyl)ethylamino]-N-(4-morpholin-4-ylphenyl)propanamide is sourced from PubChem (CID 51168773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).