2-(2-acetylanilino)-N-(4-morpholin-4-ylphenyl)acetamide

C20H23N3O3 — CID 18078616

IUPAC2-(2-acetylanilino)-N-(4-morpholin-4-ylphenyl)acetamide
SMILESCC(=O)c1ccccc1NCC(=O)Nc1ccc(N2CCOCC2)cc1
InChIInChI=1S/C20H23N3O3/c1-15(24)18-4-2-3-5-19(18)21-14-20(25)22-16-6-8-17(9-7-16)23-10-12-26-13-11-23/h2-9,21H,10-14H2,1H3,(H,22,25)
InChIKeyNCJPYTWZDZOAQK-UHFFFAOYSA-N
MW353.42 g/mol
LogP2.78
Rot. Bonds6

About 2-(2-acetylanilino)-N-(4-morpholin-4-ylphenyl)acetamide

2-(2-acetylanilino)-N-(4-morpholin-4-ylphenyl)acetamide (PubChem CID 18078616) has the molecular formula C20H23N3O3 and a molecular weight of 353.42 g/mol. Its IUPAC name is 2-(2-acetylanilino)-N-(4-morpholin-4-ylphenyl)acetamide.

Molecular Properties

Compound Name2-(2-acetylanilino)-N-(4-morpholin-4-ylphenyl)acetamide
PubChem CID18078616
Molecular FormulaC20H23N3O3
Molecular Weight353.42 g/mol
Exact Mass353.17
IUPAC Name2-(2-acetylanilino)-N-(4-morpholin-4-ylphenyl)acetamide
SMILESCC(=O)c1ccccc1NCC(=O)Nc1ccc(N2CCOCC2)cc1
InChIInChI=1S/C20H23N3O3/c1-15(24)18-4-2-3-5-19(18)21-14-20(25)22-16-6-8-17(9-7-16)23-10-12-26-13-11-23/h2-9,21H,10-14H2,1H3,(H,22,25)
InChIKeyNCJPYTWZDZOAQK-UHFFFAOYSA-N
XLogP2.78
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.42
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-(4-morpholin-4-ylphenyl)-2-(2-propylanilino)acetamide
CID 33171709
2-(2-morpholin-4-ylanilino)-N-(4-piperidin-1-ylphenyl)acetamide
CID 109010529
N-(furan-2-ylmethyl)-2-[[2-(4-morpholin-4-ylanilino)-2-oxoethyl]amino]benzamide
CID 4798851
2-(2-acetylanilino)-N-phenylacetamide
CID 9103782
2-[2-(2,6-dimethylphenoxy)anilino]-N-(4-morpholin-4-ylphenyl)acetamide
CID 60587672
methyl 2-[[2-oxo-2-(4-pyrrolidin-1-ylanilino)ethyl]amino]benzoate
CID 55434513
2-(2-acetylanilino)-N-(4-tert-butylphenyl)acetamide
CID 9103726
2-(5-acetamido-2-methoxyanilino)-N-(4-morpholin-4-ylphenyl)acetamide
CID 33161192
N-(4-methoxyphenyl)-2-(2-morpholin-4-ylanilino)acetamide
CID 109009136
2-(ethylamino)-N-(4-morpholin-4-ylphenyl)acetamide;dihydrochloride
CID 20847919
2-(2-ethylanilino)-N-(4-pyrrolidin-1-ylphenyl)acetamide
CID 37480616
2-iodo-N-[2-(4-morpholin-4-ylanilino)-2-oxoethyl]benzamide
CID 35014699

Frequently Asked Questions

What is the IUPAC name of 2-(2-acetylanilino)-N-(4-morpholin-4-ylphenyl)acetamide?
The IUPAC name of 2-(2-acetylanilino)-N-(4-morpholin-4-ylphenyl)acetamide (CID 18078616) is 2-(2-acetylanilino)-N-(4-morpholin-4-ylphenyl)acetamide.
What is the SMILES notation for 2-(2-acetylanilino)-N-(4-morpholin-4-ylphenyl)acetamide?
The canonical SMILES for 2-(2-acetylanilino)-N-(4-morpholin-4-ylphenyl)acetamide is CC(=O)c1ccccc1NCC(=O)Nc1ccc(N2CCOCC2)cc1.
What is the InChIKey of 2-(2-acetylanilino)-N-(4-morpholin-4-ylphenyl)acetamide?
The InChIKey is NCJPYTWZDZOAQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O3/c1-15(24)18-4-2-3-5-19(18)21-14-20(25)22-16-6-8-17(9-7-16)23-10-12-26-13-11-23/h2-9,21H,10-14H2,1H3,(H,22,25).
What are the key properties of 2-(2-acetylanilino)-N-(4-morpholin-4-ylphenyl)acetamide?
2-(2-acetylanilino)-N-(4-morpholin-4-ylphenyl)acetamide has a molecular weight of 353.42 g/mol, XLogP of 2.78, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-acetylanilino)-N-(4-morpholin-4-ylphenyl)acetamide is sourced from PubChem (CID 18078616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).