N-[4-(diethylamino)phenyl]-2-(4-morpholin-4-ylphenyl)acetamide

C22H29N3O2 — CID 110424765

IUPACN-[4-(diethylamino)phenyl]-2-(4-morpholin-4-ylphenyl)acetamide
SMILESCCN(CC)c1ccc(NC(=O)Cc2ccc(N3CCOCC3)cc2)cc1
InChIInChI=1S/C22H29N3O2/c1-3-24(4-2)20-11-7-19(8-12-20)23-22(26)17-18-5-9-21(10-6-18)25-13-15-27-16-14-25/h5-12H,3-4,13-17H2,1-2H3,(H,23,26)
InChIKeyPPSZHSWKKIZIRS-UHFFFAOYSA-N
MW367.49 g/mol
LogP3.55
Rot. Bonds7

About N-[4-(diethylamino)phenyl]-2-(4-morpholin-4-ylphenyl)acetamide

N-[4-(diethylamino)phenyl]-2-(4-morpholin-4-ylphenyl)acetamide (PubChem CID 110424765) has the molecular formula C22H29N3O2 and a molecular weight of 367.49 g/mol. Its IUPAC name is N-[4-(diethylamino)phenyl]-2-(4-morpholin-4-ylphenyl)acetamide.

Molecular Properties

Compound NameN-[4-(diethylamino)phenyl]-2-(4-morpholin-4-ylphenyl)acetamide
PubChem CID110424765
Molecular FormulaC22H29N3O2
Molecular Weight367.49 g/mol
Exact Mass367.23
IUPAC NameN-[4-(diethylamino)phenyl]-2-(4-morpholin-4-ylphenyl)acetamide
SMILESCCN(CC)c1ccc(NC(=O)Cc2ccc(N3CCOCC3)cc2)cc1
InChIInChI=1S/C22H29N3O2/c1-3-24(4-2)20-11-7-19(8-12-20)23-22(26)17-18-5-9-21(10-6-18)25-13-15-27-16-14-25/h5-12H,3-4,13-17H2,1-2H3,(H,23,26)
InChIKeyPPSZHSWKKIZIRS-UHFFFAOYSA-N
XLogP3.55
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.49
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}, {'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

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Related Compounds

N-[4-(dimethylamino)phenyl]-2-(4-piperidin-1-ylphenyl)acetamide
CID 110650708
N-[4-(cyclopropanecarbonyl)phenyl]-2-(4-morpholin-4-ylphenyl)acetamide
CID 110612773
2-[methyl-[2-(4-morpholin-4-ylanilino)-2-oxoethyl]amino]-N-(4-morpholin-4-ylphenyl)acetamide
CID 4831881
N-[4-(diethylamino)phenyl]-2-(4-fluorophenyl)acetamide
CID 849192
N-(4-morpholin-4-ylphenyl)pentanamide
CID 2765048
2-(ethylamino)-N-(4-morpholin-4-ylphenyl)acetamide;dihydrochloride
CID 20847919
N-[2-(diethylamino)propyl]-2-(4-morpholin-4-ylphenyl)acetamide
CID 110620370
2-[4-[acetyl(methyl)amino]phenyl]-N-[4-(diethylamino)phenyl]acetamide
CID 110674963
N-ethyl-2,2-dimethyl-N-[2-(4-morpholin-4-ylanilino)-2-oxoethyl]propanamide
CID 51156382
4-(4-ethyl-N-methylsulfonylanilino)-N-(4-morpholin-4-ylphenyl)butanamide
CID 100524022
2-(6-ethyl-1-benzofuran-3-yl)-N-(4-morpholin-4-ylphenyl)acetamide
CID 8851829
N-[4-(diethylamino)phenyl]-3-(2-morpholin-4-ylethylamino)propanamide
CID 109016821

Frequently Asked Questions

What is the IUPAC name of N-[4-(diethylamino)phenyl]-2-(4-morpholin-4-ylphenyl)acetamide?
The IUPAC name of N-[4-(diethylamino)phenyl]-2-(4-morpholin-4-ylphenyl)acetamide (CID 110424765) is N-[4-(diethylamino)phenyl]-2-(4-morpholin-4-ylphenyl)acetamide.
What is the SMILES notation for N-[4-(diethylamino)phenyl]-2-(4-morpholin-4-ylphenyl)acetamide?
The canonical SMILES for N-[4-(diethylamino)phenyl]-2-(4-morpholin-4-ylphenyl)acetamide is CCN(CC)c1ccc(NC(=O)Cc2ccc(N3CCOCC3)cc2)cc1.
What is the InChIKey of N-[4-(diethylamino)phenyl]-2-(4-morpholin-4-ylphenyl)acetamide?
The InChIKey is PPSZHSWKKIZIRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H29N3O2/c1-3-24(4-2)20-11-7-19(8-12-20)23-22(26)17-18-5-9-21(10-6-18)25-13-15-27-16-14-25/h5-12H,3-4,13-17H2,1-2H3,(H,23,26).
What are the key properties of N-[4-(diethylamino)phenyl]-2-(4-morpholin-4-ylphenyl)acetamide?
N-[4-(diethylamino)phenyl]-2-(4-morpholin-4-ylphenyl)acetamide has a molecular weight of 367.49 g/mol, XLogP of 3.55, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(diethylamino)phenyl]-2-(4-morpholin-4-ylphenyl)acetamide is sourced from PubChem (CID 110424765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).